USER MOD reduce.3.24.130724 H: found=0, std=0, add=1109, rem=0, adj=52 USER MOD reduce.3.24.130724 removed 1109 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 113 HIS : no HD1:sc= -0.268 X(o=-0.74,f=-0.6) USER MOD Set 1.2: A 124 SER OG : rot -76:sc= -0.475 USER MOD Set 2.1: A 39 LYS NZ :NH3+ 172:sc= 0.367 (180deg=-0.105) USER MOD Set 2.2: A 64 SER OG : rot -46:sc= 0.351 USER MOD Set 3.1: A 7 ASN : amide:sc= -0.194 X(o=-0.083,f=-0.29) USER MOD Set 3.2: A 36 TYR OH : rot 180:sc= 0 USER MOD Set 3.3: A 59 THR OG1 : rot -140:sc= 0.111 USER MOD Set 4.1: A 51 ASN : amide:sc= 0.852 K(o=1.6,f=-4.1!) USER MOD Set 4.2: A 52 ASN : amide:sc= 0.763 K(o=1.6,f=-4.3) USER MOD Set 5.1: A 38 ASN : amide:sc= -2.08! C(o=-0.36!,f=-0.47!) USER MOD Set 5.2: A 40 THR OG1 : rot 118:sc= 1.72 USER MOD Set 6.1: A 22 ASN : amide:sc= 0.498 K(o=1.5,f=-8.7!) USER MOD Set 6.2: A 143 LYS NZ :NH3+ 143:sc= 0.967 (180deg=-0.246) USER MOD Set 7.1: A 21 SER OG : rot -164:sc= 0.535 USER MOD Set 7.2: A 93 THR OG1 : rot 145:sc= 0.777 USER MOD Single : A 5 MET CE :methyl -152:sc= -1.91 (180deg=-2.2!) USER MOD Single : A 6 THR OG1 : rot 151:sc= 0.292 USER MOD Single : A 9 GLN : amide:sc= -0.0226 K(o=-0.023,f=-0.99) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ -149:sc= 2.37 (180deg=1.47) USER MOD Single : A 17 SER OG : rot 54:sc= 0.748 USER MOD Single : A 25 SER OG : rot 98:sc= 0.852 USER MOD Single : A 27 ASN : amide:sc= -0.081 X(o=-0.081,f=-0.0003) USER MOD Single : A 29 ASN : amide:sc= -2.37! K(o=-2.4!,f=-1.2) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.241 USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 35:sc= -0.905 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -0.139 K(o=-0.14,f=-0.73) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot -50:sc= 0.0615 USER MOD Single : A 61 SER OG : rot -93:sc= 0.339 USER MOD Single : A 62 ASN : amide:sc= -0.0148 K(o=-0.015,f=-1.2!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ -158:sc= -0.0253 (180deg=-0.19) USER MOD Single : A 73 LYS NZ :NH3+ -154:sc= 1.27 (180deg=0.766) USER MOD Single : A 75 ASN : amide:sc= -0.367 X(o=-0.37,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0.051 USER MOD Single : A 82 ASN : amide:sc= -0.0152 X(o=-0.015,f=-0.015) USER MOD Single : A 83 THR OG1 : rot -161:sc= 1.25 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot -59:sc= 0.353 USER MOD Single : A 90 SER OG : rot -21:sc= 0.00519 USER MOD Single : A 92 LYS NZ :NH3+ -148:sc= 1.26 (180deg=1.2) USER MOD Single : A 95 THR OG1 : rot -8:sc= 0.697 USER MOD Single : A 96 SER OG : rot 180:sc= 0.0565 USER MOD Single : A 97 LYS NZ :NH3+ -157:sc= 0.299 (180deg=0.148) USER MOD Single : A 99 LYS NZ :NH3+ -125:sc= 0.638 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 THR OG1 : rot 78:sc= 0.683 USER MOD Single : A 108 GLN : amide:sc= 0.392 K(o=0.39,f=-5.1!) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 CYS SG : rot -105:sc= 0.704 USER MOD Single : A 115 ASN : amide:sc= 0.458 K(o=0.46,f=-4.1!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 180:sc= -0.0195 USER MOD Single : A 120 ASN : amide:sc= -0.0901 X(o=-0.09,f=-0.11) USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.0715 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot -101:sc= 0.0613 USER MOD Single : A 126 SER OG : rot 180:sc= -0.186 USER MOD Single : A 128 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.056) USER MOD Single : A 134 THR OG1 : rot -39:sc= 0.106 USER MOD Single : A 135 SER OG : rot 180:sc= -0.0551 USER MOD Single : A 137 ASN : amide:sc= 0.163 K(o=0.16,f=-2.2!) USER MOD Single : A 139 THR OG1 : rot 100:sc= 1.39 USER MOD Single : A 140 THR OG1 : rot 28:sc= 1.13 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 LYS NZ :NH3+ -129:sc= 0.0468 (180deg=0) USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 60 N MET A 5 18.097 -2.873 3.101 1.00 32.30 N ATOM 61 CA MET A 5 17.347 -4.115 2.928 1.00 24.01 C ATOM 62 C MET A 5 17.360 -4.653 1.488 1.00 45.35 C ATOM 63 O MET A 5 17.707 -3.940 0.540 1.00 44.33 O ATOM 64 CB MET A 5 15.907 -3.888 3.398 1.00 3.41 C ATOM 65 CG MET A 5 15.156 -2.843 2.579 1.00 3.24 C ATOM 66 SD MET A 5 15.477 -1.109 2.998 1.00 31.53 S ATOM 67 CE MET A 5 14.608 -0.313 1.631 1.00 42.54 C ATOM 0 HA MET A 5 17.840 -4.878 3.530 1.00 24.01 H new ATOM 0 HB2 MET A 5 15.365 -4.833 3.351 1.00 3.41 H new ATOM 0 HB3 MET A 5 15.919 -3.579 4.443 1.00 3.41 H new ATOM 0 HG2 MET A 5 15.402 -2.992 1.527 1.00 3.24 H new ATOM 0 HG3 MET A 5 14.087 -3.028 2.686 1.00 3.24 H new ATOM 0 HE1 MET A 5 15.071 0.650 1.417 1.00 42.54 H new ATOM 0 HE2 MET A 5 14.664 -0.947 0.746 1.00 42.54 H new ATOM 0 HE3 MET A 5 13.564 -0.161 1.903 1.00 42.54 H new ATOM 77 N THR A 6 16.954 -5.915 1.318 1.00 45.13 N ATOM 78 CA THR A 6 16.688 -6.580 0.040 1.00 41.42 C ATOM 79 C THR A 6 15.242 -6.309 -0.408 1.00 30.20 C ATOM 80 O THR A 6 14.501 -5.652 0.326 1.00 25.30 O ATOM 81 CB THR A 6 16.967 -8.087 0.195 1.00 31.00 C ATOM 82 OG1 THR A 6 16.313 -8.628 1.332 1.00 21.20 O ATOM 83 CG2 THR A 6 18.463 -8.368 0.341 1.00 71.42 C ATOM 0 H THR A 6 16.793 -6.534 2.113 1.00 45.13 H new ATOM 0 HA THR A 6 17.345 -6.184 -0.735 1.00 41.42 H new ATOM 0 HB THR A 6 16.584 -8.557 -0.711 1.00 31.00 H new ATOM 0 HG1 THR A 6 16.106 -9.572 1.172 1.00 21.20 H new ATOM 0 HG21 THR A 6 18.623 -9.441 0.448 1.00 71.42 H new ATOM 0 HG22 THR A 6 18.989 -8.009 -0.544 1.00 71.42 H new ATOM 0 HG23 THR A 6 18.845 -7.854 1.223 1.00 71.42 H new ATOM 91 N ASN A 7 14.830 -6.807 -1.587 1.00 50.35 N ATOM 92 CA ASN A 7 13.482 -6.599 -2.141 1.00 30.01 C ATOM 93 C ASN A 7 12.388 -7.052 -1.177 1.00 31.23 C ATOM 94 O ASN A 7 11.674 -6.201 -0.660 1.00 24.21 O ATOM 95 CB ASN A 7 13.325 -7.267 -3.518 1.00 30.34 C ATOM 96 CG ASN A 7 13.224 -6.262 -4.660 1.00 2.14 C ATOM 97 OD1 ASN A 7 12.443 -6.450 -5.577 1.00 4.14 O ATOM 98 ND2 ASN A 7 14.001 -5.191 -4.659 1.00 24.23 N ATOM 0 H ASN A 7 15.431 -7.371 -2.188 1.00 50.35 H new ATOM 0 HA ASN A 7 13.362 -5.525 -2.280 1.00 30.01 H new ATOM 0 HB2 ASN A 7 14.175 -7.926 -3.695 1.00 30.34 H new ATOM 0 HB3 ASN A 7 12.433 -7.893 -3.512 1.00 30.34 H new ATOM 0 HD21 ASN A 7 13.947 -4.521 -5.426 1.00 24.23 H new ATOM 0 HD22 ASN A 7 14.654 -5.035 -3.891 1.00 24.23 H new ATOM 105 N GLY A 8 12.278 -8.350 -0.885 1.00 24.00 N ATOM 106 CA GLY A 8 11.308 -8.886 0.076 1.00 42.34 C ATOM 107 C GLY A 8 11.297 -8.125 1.405 1.00 12.34 C ATOM 108 O GLY A 8 10.231 -7.821 1.930 1.00 72.54 O ATOM 0 H GLY A 8 12.865 -9.066 -1.313 1.00 24.00 H new ATOM 0 HA2 GLY A 8 10.312 -8.851 -0.364 1.00 42.34 H new ATOM 0 HA3 GLY A 8 11.535 -9.935 0.266 1.00 42.34 H new ATOM 112 N GLN A 9 12.464 -7.754 1.949 1.00 51.02 N ATOM 113 CA GLN A 9 12.547 -6.998 3.199 1.00 42.35 C ATOM 114 C GLN A 9 12.065 -5.539 3.046 1.00 23.13 C ATOM 115 O GLN A 9 11.524 -4.990 4.005 1.00 64.41 O ATOM 116 CB GLN A 9 13.993 -7.029 3.721 1.00 72.22 C ATOM 117 CG GLN A 9 14.411 -8.201 4.619 1.00 23.34 C ATOM 118 CD GLN A 9 13.837 -9.571 4.259 1.00 43.25 C ATOM 119 OE1 GLN A 9 12.720 -9.897 4.645 1.00 13.32 O ATOM 120 NE2 GLN A 9 14.596 -10.423 3.593 1.00 72.34 N ATOM 0 H GLN A 9 13.371 -7.970 1.535 1.00 51.02 H new ATOM 0 HA GLN A 9 11.879 -7.475 3.916 1.00 42.35 H new ATOM 0 HB2 GLN A 9 14.659 -7.015 2.859 1.00 72.22 H new ATOM 0 HB3 GLN A 9 14.168 -6.106 4.274 1.00 72.22 H new ATOM 0 HG2 GLN A 9 15.499 -8.272 4.604 1.00 23.34 H new ATOM 0 HG3 GLN A 9 14.120 -7.967 5.643 1.00 23.34 H new ATOM 0 HE21 GLN A 9 15.524 -10.140 3.277 1.00 72.34 H new ATOM 0 HE22 GLN A 9 14.254 -11.363 3.395 1.00 72.34 H new ATOM 129 N LEU A 10 12.255 -4.878 1.894 1.00 13.13 N ATOM 130 CA LEU A 10 11.687 -3.576 1.587 1.00 63.55 C ATOM 131 C LEU A 10 10.180 -3.744 1.558 1.00 4.20 C ATOM 132 O LEU A 10 9.473 -3.059 2.297 1.00 3.15 O ATOM 133 CB LEU A 10 12.263 -3.104 0.235 1.00 10.21 C ATOM 134 CG LEU A 10 11.880 -1.678 -0.188 1.00 62.02 C ATOM 135 CD1 LEU A 10 12.749 -1.270 -1.380 1.00 4.42 C ATOM 136 CD2 LEU A 10 10.424 -1.471 -0.522 1.00 25.43 C ATOM 0 H LEU A 10 12.825 -5.253 1.136 1.00 13.13 H new ATOM 0 HA LEU A 10 11.936 -2.816 2.328 1.00 63.55 H new ATOM 0 HB2 LEU A 10 13.350 -3.171 0.280 1.00 10.21 H new ATOM 0 HB3 LEU A 10 11.933 -3.795 -0.541 1.00 10.21 H new ATOM 0 HG LEU A 10 12.058 -1.048 0.683 1.00 62.02 H new ATOM 0 HD11 LEU A 10 12.488 -0.259 -1.691 1.00 4.42 H new ATOM 0 HD12 LEU A 10 13.800 -1.301 -1.092 1.00 4.42 H new ATOM 0 HD13 LEU A 10 12.579 -1.960 -2.207 1.00 4.42 H new ATOM 0 HD21 LEU A 10 10.260 -0.432 -0.808 1.00 25.43 H new ATOM 0 HD22 LEU A 10 10.144 -2.123 -1.349 1.00 25.43 H new ATOM 0 HD23 LEU A 10 9.814 -1.708 0.349 1.00 25.43 H new ATOM 148 N TRP A 11 9.710 -4.667 0.719 1.00 4.12 N ATOM 149 CA TRP A 11 8.299 -4.903 0.516 1.00 53.25 C ATOM 150 C TRP A 11 7.623 -5.221 1.849 1.00 34.53 C ATOM 151 O TRP A 11 6.623 -4.593 2.171 1.00 24.11 O ATOM 152 CB TRP A 11 8.089 -6.010 -0.526 1.00 5.53 C ATOM 153 CG TRP A 11 6.655 -6.335 -0.796 1.00 65.02 C ATOM 154 CD1 TRP A 11 5.886 -5.824 -1.785 1.00 11.51 C ATOM 155 CD2 TRP A 11 5.802 -7.272 -0.077 1.00 22.10 C ATOM 156 NE1 TRP A 11 4.602 -6.315 -1.674 1.00 30.32 N ATOM 157 CE2 TRP A 11 4.498 -7.212 -0.643 1.00 4.01 C ATOM 158 CE3 TRP A 11 6.012 -8.192 0.972 1.00 51.24 C ATOM 159 CZ2 TRP A 11 3.449 -8.015 -0.198 1.00 33.30 C ATOM 160 CZ3 TRP A 11 4.960 -9.000 1.444 1.00 72.41 C ATOM 161 CH2 TRP A 11 3.682 -8.908 0.861 1.00 12.33 C ATOM 0 H TRP A 11 10.312 -5.272 0.161 1.00 4.12 H new ATOM 0 HA TRP A 11 7.831 -4.001 0.123 1.00 53.25 H new ATOM 0 HB2 TRP A 11 8.563 -5.709 -1.460 1.00 5.53 H new ATOM 0 HB3 TRP A 11 8.597 -6.913 -0.187 1.00 5.53 H new ATOM 0 HD1 TRP A 11 6.226 -5.136 -2.545 1.00 11.51 H new ATOM 0 HE1 TRP A 11 3.829 -6.045 -2.282 1.00 30.32 H new ATOM 0 HE3 TRP A 11 6.992 -8.277 1.418 1.00 51.24 H new ATOM 0 HZ2 TRP A 11 2.474 -7.952 -0.659 1.00 33.30 H new ATOM 0 HZ3 TRP A 11 5.134 -9.692 2.255 1.00 72.41 H new ATOM 0 HH2 TRP A 11 2.877 -9.527 1.230 1.00 12.33 H new ATOM 172 N LYS A 12 8.186 -6.103 2.686 1.00 11.24 N ATOM 173 CA LYS A 12 7.612 -6.453 3.987 1.00 24.42 C ATOM 174 C LYS A 12 7.384 -5.246 4.881 1.00 43.42 C ATOM 175 O LYS A 12 6.361 -5.213 5.554 1.00 10.03 O ATOM 176 CB LYS A 12 8.468 -7.472 4.754 1.00 21.43 C ATOM 177 CG LYS A 12 8.131 -8.929 4.397 1.00 64.54 C ATOM 178 CD LYS A 12 8.211 -9.834 5.633 1.00 3.34 C ATOM 179 CE LYS A 12 9.637 -9.883 6.213 1.00 2.30 C ATOM 180 NZ LYS A 12 9.961 -11.169 6.870 1.00 71.34 N ATOM 0 H LYS A 12 9.055 -6.594 2.477 1.00 11.24 H new ATOM 0 HA LYS A 12 6.647 -6.900 3.746 1.00 24.42 H new ATOM 0 HB2 LYS A 12 9.521 -7.286 4.542 1.00 21.43 H new ATOM 0 HB3 LYS A 12 8.327 -7.324 5.825 1.00 21.43 H new ATOM 0 HG2 LYS A 12 7.129 -8.980 3.970 1.00 64.54 H new ATOM 0 HG3 LYS A 12 8.821 -9.289 3.634 1.00 64.54 H new ATOM 0 HD2 LYS A 12 7.521 -9.471 6.395 1.00 3.34 H new ATOM 0 HD3 LYS A 12 7.892 -10.842 5.367 1.00 3.34 H new ATOM 0 HE2 LYS A 12 10.353 -9.702 5.412 1.00 2.30 H new ATOM 0 HE3 LYS A 12 9.756 -9.075 6.935 1.00 2.30 H new ATOM 0 HZ1 LYS A 12 10.933 -11.136 7.238 1.00 71.34 H new ATOM 0 HZ2 LYS A 12 9.299 -11.334 7.655 1.00 71.34 H new ATOM 0 HZ3 LYS A 12 9.879 -11.942 6.179 1.00 71.34 H new ATOM 194 N LYS A 13 8.291 -4.266 4.906 1.00 42.01 N ATOM 195 CA LYS A 13 8.076 -3.056 5.703 1.00 65.44 C ATOM 196 C LYS A 13 6.792 -2.363 5.255 1.00 41.40 C ATOM 197 O LYS A 13 6.012 -1.932 6.100 1.00 23.43 O ATOM 198 CB LYS A 13 9.279 -2.113 5.584 1.00 61.31 C ATOM 199 CG LYS A 13 10.556 -2.700 6.205 1.00 74.20 C ATOM 200 CD LYS A 13 11.802 -2.000 5.646 1.00 5.22 C ATOM 201 CE LYS A 13 13.078 -2.742 6.051 1.00 50.35 C ATOM 202 NZ LYS A 13 13.489 -2.488 7.445 1.00 13.43 N ATOM 0 H LYS A 13 9.171 -4.285 4.390 1.00 42.01 H new ATOM 0 HA LYS A 13 7.973 -3.334 6.752 1.00 65.44 H new ATOM 0 HB2 LYS A 13 9.460 -1.892 4.532 1.00 61.31 H new ATOM 0 HB3 LYS A 13 9.044 -1.167 6.072 1.00 61.31 H new ATOM 0 HG2 LYS A 13 10.525 -2.587 7.289 1.00 74.20 H new ATOM 0 HG3 LYS A 13 10.609 -3.769 5.997 1.00 74.20 H new ATOM 0 HD2 LYS A 13 11.737 -1.948 4.559 1.00 5.22 H new ATOM 0 HD3 LYS A 13 11.842 -0.974 6.012 1.00 5.22 H new ATOM 0 HE2 LYS A 13 12.925 -3.813 5.915 1.00 50.35 H new ATOM 0 HE3 LYS A 13 13.887 -2.448 5.383 1.00 50.35 H new ATOM 0 HZ1 LYS A 13 14.358 -3.020 7.653 1.00 13.43 H new ATOM 0 HZ2 LYS A 13 13.666 -1.471 7.575 1.00 13.43 H new ATOM 0 HZ3 LYS A 13 12.733 -2.793 8.091 1.00 13.43 H new ATOM 216 N VAL A 14 6.560 -2.266 3.943 1.00 31.32 N ATOM 217 CA VAL A 14 5.321 -1.720 3.401 1.00 12.03 C ATOM 218 C VAL A 14 4.159 -2.685 3.692 1.00 2.14 C ATOM 219 O VAL A 14 3.073 -2.232 4.055 1.00 42.32 O ATOM 220 CB VAL A 14 5.471 -1.429 1.891 1.00 64.53 C ATOM 221 CG1 VAL A 14 4.213 -0.766 1.318 1.00 74.51 C ATOM 222 CG2 VAL A 14 6.665 -0.504 1.598 1.00 71.41 C ATOM 0 H VAL A 14 7.227 -2.564 3.231 1.00 31.32 H new ATOM 0 HA VAL A 14 5.098 -0.770 3.887 1.00 12.03 H new ATOM 0 HB VAL A 14 5.633 -2.397 1.418 1.00 64.53 H new ATOM 0 HG11 VAL A 14 4.354 -0.576 0.254 1.00 74.51 H new ATOM 0 HG12 VAL A 14 3.358 -1.427 1.458 1.00 74.51 H new ATOM 0 HG13 VAL A 14 4.031 0.177 1.834 1.00 74.51 H new ATOM 0 HG21 VAL A 14 6.733 -0.326 0.525 1.00 71.41 H new ATOM 0 HG22 VAL A 14 6.525 0.445 2.115 1.00 71.41 H new ATOM 0 HG23 VAL A 14 7.584 -0.975 1.946 1.00 71.41 H new ATOM 232 N LYS A 15 4.352 -4.005 3.593 1.00 12.21 N ATOM 233 CA LYS A 15 3.306 -4.981 3.867 1.00 33.31 C ATOM 234 C LYS A 15 2.770 -4.765 5.274 1.00 5.13 C ATOM 235 O LYS A 15 1.594 -4.425 5.441 1.00 61.54 O ATOM 236 CB LYS A 15 3.787 -6.432 3.681 1.00 62.32 C ATOM 237 CG LYS A 15 2.575 -7.375 3.754 1.00 71.52 C ATOM 238 CD LYS A 15 2.799 -8.683 4.516 1.00 25.51 C ATOM 239 CE LYS A 15 1.435 -9.379 4.477 1.00 44.43 C ATOM 240 NZ LYS A 15 1.407 -10.696 5.130 1.00 11.01 N ATOM 0 H LYS A 15 5.242 -4.422 3.320 1.00 12.21 H new ATOM 0 HA LYS A 15 2.507 -4.828 3.141 1.00 33.31 H new ATOM 0 HB2 LYS A 15 4.291 -6.541 2.721 1.00 62.32 H new ATOM 0 HB3 LYS A 15 4.512 -6.690 4.453 1.00 62.32 H new ATOM 0 HG2 LYS A 15 1.749 -6.840 4.222 1.00 71.52 H new ATOM 0 HG3 LYS A 15 2.264 -7.616 2.738 1.00 71.52 H new ATOM 0 HD2 LYS A 15 3.570 -9.292 4.044 1.00 25.51 H new ATOM 0 HD3 LYS A 15 3.122 -8.497 5.540 1.00 25.51 H new ATOM 0 HE2 LYS A 15 0.698 -8.734 4.955 1.00 44.43 H new ATOM 0 HE3 LYS A 15 1.130 -9.496 3.437 1.00 44.43 H new ATOM 0 HZ1 LYS A 15 0.711 -11.305 4.654 1.00 11.01 H new ATOM 0 HZ2 LYS A 15 2.348 -11.134 5.069 1.00 11.01 H new ATOM 0 HZ3 LYS A 15 1.142 -10.582 6.129 1.00 11.01 H new ATOM 254 N ASP A 16 3.642 -4.956 6.262 1.00 11.32 N ATOM 255 CA ASP A 16 3.326 -4.873 7.677 1.00 24.45 C ATOM 256 C ASP A 16 2.992 -3.438 8.127 1.00 70.42 C ATOM 257 O ASP A 16 2.627 -3.242 9.288 1.00 14.43 O ATOM 258 CB ASP A 16 4.481 -5.452 8.520 1.00 22.42 C ATOM 259 CG ASP A 16 4.333 -6.951 8.793 1.00 5.20 C ATOM 260 OD1 ASP A 16 4.219 -7.731 7.821 1.00 43.12 O ATOM 261 OD2 ASP A 16 4.362 -7.335 9.988 1.00 74.55 O ATOM 0 H ASP A 16 4.622 -5.181 6.088 1.00 11.32 H new ATOM 0 HA ASP A 16 2.429 -5.470 7.840 1.00 24.45 H new ATOM 0 HB2 ASP A 16 5.424 -5.274 8.003 1.00 22.42 H new ATOM 0 HB3 ASP A 16 4.532 -4.919 9.470 1.00 22.42 H new ATOM 266 N SER A 17 3.075 -2.410 7.264 1.00 31.51 N ATOM 267 CA SER A 17 2.404 -1.150 7.573 1.00 41.12 C ATOM 268 C SER A 17 0.898 -1.365 7.577 1.00 61.52 C ATOM 269 O SER A 17 0.264 -1.257 8.620 1.00 43.21 O ATOM 270 CB SER A 17 2.784 0.053 6.689 1.00 42.01 C ATOM 271 OG SER A 17 3.581 -0.220 5.576 1.00 1.12 O ATOM 0 H SER A 17 3.583 -2.429 6.379 1.00 31.51 H new ATOM 0 HA SER A 17 2.763 -0.868 8.563 1.00 41.12 H new ATOM 0 HB2 SER A 17 1.865 0.526 6.343 1.00 42.01 H new ATOM 0 HB3 SER A 17 3.304 0.782 7.310 1.00 42.01 H new ATOM 0 HG SER A 17 3.163 -0.926 5.040 1.00 1.12 H new ATOM 277 N LEU A 18 0.350 -1.686 6.407 1.00 43.33 N ATOM 278 CA LEU A 18 -1.079 -1.843 6.151 1.00 61.53 C ATOM 279 C LEU A 18 -1.725 -2.878 7.062 1.00 21.24 C ATOM 280 O LEU A 18 -2.906 -2.744 7.343 1.00 50.12 O ATOM 281 CB LEU A 18 -1.352 -2.236 4.686 1.00 25.25 C ATOM 282 CG LEU A 18 -1.093 -1.181 3.597 1.00 12.31 C ATOM 283 CD1 LEU A 18 -1.551 0.205 4.036 1.00 3.35 C ATOM 284 CD2 LEU A 18 0.370 -1.101 3.157 1.00 11.24 C ATOM 0 H LEU A 18 0.916 -1.851 5.575 1.00 43.33 H new ATOM 0 HA LEU A 18 -1.523 -0.870 6.359 1.00 61.53 H new ATOM 0 HB2 LEU A 18 -0.744 -3.111 4.456 1.00 25.25 H new ATOM 0 HB3 LEU A 18 -2.395 -2.544 4.611 1.00 25.25 H new ATOM 0 HG LEU A 18 -1.681 -1.514 2.742 1.00 12.31 H new ATOM 0 HD11 LEU A 18 -1.352 0.923 3.241 1.00 3.35 H new ATOM 0 HD12 LEU A 18 -2.620 0.185 4.247 1.00 3.35 H new ATOM 0 HD13 LEU A 18 -1.009 0.499 4.935 1.00 3.35 H new ATOM 0 HD21 LEU A 18 0.477 -0.336 2.388 1.00 11.24 H new ATOM 0 HD22 LEU A 18 0.994 -0.844 4.013 1.00 11.24 H new ATOM 0 HD23 LEU A 18 0.683 -2.065 2.756 1.00 11.24 H new ATOM 296 N ILE A 19 -0.961 -3.863 7.543 1.00 11.32 N ATOM 297 CA ILE A 19 -1.390 -4.830 8.559 1.00 70.34 C ATOM 298 C ILE A 19 -1.968 -4.112 9.784 1.00 72.34 C ATOM 299 O ILE A 19 -2.900 -4.609 10.416 1.00 4.03 O ATOM 300 CB ILE A 19 -0.189 -5.719 8.965 1.00 1.02 C ATOM 301 CG1 ILE A 19 0.285 -6.653 7.838 1.00 63.13 C ATOM 302 CG2 ILE A 19 -0.430 -6.515 10.256 1.00 11.11 C ATOM 303 CD1 ILE A 19 -0.661 -7.773 7.469 1.00 65.14 C ATOM 0 H ILE A 19 -0.002 -4.014 7.229 1.00 11.32 H new ATOM 0 HA ILE A 19 -2.175 -5.459 8.140 1.00 70.34 H new ATOM 0 HB ILE A 19 0.615 -5.010 9.163 1.00 1.02 H new ATOM 0 HG12 ILE A 19 0.471 -6.052 6.948 1.00 63.13 H new ATOM 0 HG13 ILE A 19 1.239 -7.091 8.132 1.00 63.13 H new ATOM 0 HG21 ILE A 19 0.451 -7.116 10.482 1.00 11.11 H new ATOM 0 HG22 ILE A 19 -0.620 -5.825 11.079 1.00 11.11 H new ATOM 0 HG23 ILE A 19 -1.292 -7.169 10.125 1.00 11.11 H new ATOM 0 HD11 ILE A 19 -0.226 -8.367 6.665 1.00 65.14 H new ATOM 0 HD12 ILE A 19 -0.830 -8.408 8.339 1.00 65.14 H new ATOM 0 HD13 ILE A 19 -1.610 -7.353 7.136 1.00 65.14 H new ATOM 315 N ASP A 20 -1.396 -2.966 10.151 1.00 72.41 N ATOM 316 CA ASP A 20 -1.832 -2.167 11.290 1.00 4.22 C ATOM 317 C ASP A 20 -3.272 -1.689 11.151 1.00 30.31 C ATOM 318 O ASP A 20 -3.908 -1.379 12.160 1.00 51.44 O ATOM 319 CB ASP A 20 -0.934 -0.934 11.461 1.00 74.13 C ATOM 320 CG ASP A 20 -0.977 -0.477 12.913 1.00 70.34 C ATOM 321 OD1 ASP A 20 -0.460 -1.247 13.755 1.00 41.34 O ATOM 322 OD2 ASP A 20 -1.472 0.630 13.207 1.00 5.21 O ATOM 0 H ASP A 20 -0.602 -2.561 9.654 1.00 72.41 H new ATOM 0 HA ASP A 20 -1.762 -2.818 12.161 1.00 4.22 H new ATOM 0 HB2 ASP A 20 0.090 -1.173 11.173 1.00 74.13 H new ATOM 0 HB3 ASP A 20 -1.270 -0.131 10.805 1.00 74.13 H new ATOM 327 N SER A 21 -3.785 -1.630 9.918 1.00 41.12 N ATOM 328 CA SER A 21 -5.056 -0.999 9.608 1.00 72.51 C ATOM 329 C SER A 21 -6.005 -1.964 8.891 1.00 74.34 C ATOM 330 O SER A 21 -5.609 -3.020 8.387 1.00 13.14 O ATOM 331 CB SER A 21 -4.772 0.237 8.753 1.00 4.15 C ATOM 332 OG SER A 21 -5.608 1.309 9.127 1.00 3.21 O ATOM 0 H SER A 21 -3.318 -2.026 9.103 1.00 41.12 H new ATOM 0 HA SER A 21 -5.557 -0.708 10.531 1.00 72.51 H new ATOM 0 HB2 SER A 21 -3.728 0.529 8.864 1.00 4.15 H new ATOM 0 HB3 SER A 21 -4.927 -0.000 7.700 1.00 4.15 H new ATOM 0 HG SER A 21 -5.598 1.992 8.425 1.00 3.21 H new ATOM 338 N ASN A 22 -7.266 -1.560 8.755 1.00 53.44 N ATOM 339 CA ASN A 22 -8.303 -2.297 8.036 1.00 1.42 C ATOM 340 C ASN A 22 -8.178 -2.162 6.509 1.00 45.14 C ATOM 341 O ASN A 22 -9.176 -2.086 5.792 1.00 4.44 O ATOM 342 CB ASN A 22 -9.687 -1.883 8.538 1.00 44.11 C ATOM 343 CG ASN A 22 -10.753 -2.914 8.168 1.00 51.43 C ATOM 344 OD1 ASN A 22 -10.461 -4.033 7.751 1.00 41.40 O ATOM 345 ND2 ASN A 22 -12.020 -2.574 8.319 1.00 54.22 N ATOM 0 H ASN A 22 -7.605 -0.685 9.154 1.00 53.44 H new ATOM 0 HA ASN A 22 -8.163 -3.357 8.248 1.00 1.42 H new ATOM 0 HB2 ASN A 22 -9.660 -1.760 9.621 1.00 44.11 H new ATOM 0 HB3 ASN A 22 -9.954 -0.915 8.114 1.00 44.11 H new ATOM 0 HD21 ASN A 22 -12.758 -3.240 8.090 1.00 54.22 H new ATOM 0 HD22 ASN A 22 -12.261 -1.645 8.665 1.00 54.22 H new ATOM 352 N ILE A 23 -6.956 -2.047 5.979 1.00 50.42 N ATOM 353 CA ILE A 23 -6.728 -1.690 4.578 1.00 10.02 C ATOM 354 C ILE A 23 -6.578 -2.951 3.727 1.00 73.24 C ATOM 355 O ILE A 23 -7.142 -3.001 2.631 1.00 70.51 O ATOM 356 CB ILE A 23 -5.538 -0.707 4.462 1.00 1.34 C ATOM 357 CG1 ILE A 23 -5.945 0.634 5.117 1.00 21.34 C ATOM 358 CG2 ILE A 23 -5.156 -0.457 2.991 1.00 51.12 C ATOM 359 CD1 ILE A 23 -4.800 1.628 5.337 1.00 61.54 C ATOM 0 H ILE A 23 -6.099 -2.199 6.510 1.00 50.42 H new ATOM 0 HA ILE A 23 -7.595 -1.161 4.181 1.00 10.02 H new ATOM 0 HB ILE A 23 -4.674 -1.141 4.965 1.00 1.34 H new ATOM 0 HG12 ILE A 23 -6.702 1.109 4.493 1.00 21.34 H new ATOM 0 HG13 ILE A 23 -6.411 0.423 6.079 1.00 21.34 H new ATOM 0 HG21 ILE A 23 -4.317 0.238 2.946 1.00 51.12 H new ATOM 0 HG22 ILE A 23 -4.872 -1.400 2.524 1.00 51.12 H new ATOM 0 HG23 ILE A 23 -6.008 -0.032 2.461 1.00 51.12 H new ATOM 0 HD11 ILE A 23 -5.189 2.534 5.801 1.00 61.54 H new ATOM 0 HD12 ILE A 23 -4.050 1.180 5.989 1.00 61.54 H new ATOM 0 HD13 ILE A 23 -4.345 1.877 4.378 1.00 61.54 H new ATOM 371 N ILE A 24 -5.867 -3.969 4.214 1.00 72.42 N ATOM 372 CA ILE A 24 -5.661 -5.240 3.523 1.00 12.04 C ATOM 373 C ILE A 24 -6.000 -6.352 4.506 1.00 44.01 C ATOM 374 O ILE A 24 -5.705 -6.219 5.687 1.00 41.22 O ATOM 375 CB ILE A 24 -4.223 -5.350 2.964 1.00 71.31 C ATOM 376 CG1 ILE A 24 -3.107 -5.298 4.036 1.00 11.11 C ATOM 377 CG2 ILE A 24 -3.941 -4.240 1.933 1.00 54.43 C ATOM 378 CD1 ILE A 24 -2.661 -6.661 4.568 1.00 65.20 C ATOM 0 H ILE A 24 -5.407 -3.930 5.124 1.00 72.42 H new ATOM 0 HA ILE A 24 -6.312 -5.318 2.652 1.00 12.04 H new ATOM 0 HB ILE A 24 -4.192 -6.337 2.504 1.00 71.31 H new ATOM 0 HG12 ILE A 24 -2.241 -4.788 3.614 1.00 11.11 H new ATOM 0 HG13 ILE A 24 -3.456 -4.694 4.873 1.00 11.11 H new ATOM 0 HG21 ILE A 24 -2.923 -4.342 1.557 1.00 54.43 H new ATOM 0 HG22 ILE A 24 -4.644 -4.326 1.104 1.00 54.43 H new ATOM 0 HG23 ILE A 24 -4.056 -3.265 2.407 1.00 54.43 H new ATOM 0 HD11 ILE A 24 -1.877 -6.522 5.313 1.00 65.20 H new ATOM 0 HD12 ILE A 24 -3.510 -7.169 5.025 1.00 65.20 H new ATOM 0 HD13 ILE A 24 -2.277 -7.265 3.746 1.00 65.20 H new ATOM 390 N SER A 25 -6.627 -7.429 4.045 1.00 12.15 N ATOM 391 CA SER A 25 -6.974 -8.574 4.886 1.00 43.11 C ATOM 392 C SER A 25 -5.707 -9.315 5.341 1.00 42.34 C ATOM 393 O SER A 25 -5.645 -9.824 6.458 1.00 33.11 O ATOM 394 CB SER A 25 -7.887 -9.529 4.102 1.00 43.45 C ATOM 395 OG SER A 25 -8.810 -8.839 3.264 1.00 24.53 O ATOM 0 H SER A 25 -6.912 -7.535 3.071 1.00 12.15 H new ATOM 0 HA SER A 25 -7.498 -8.214 5.771 1.00 43.11 H new ATOM 0 HB2 SER A 25 -7.274 -10.193 3.492 1.00 43.45 H new ATOM 0 HB3 SER A 25 -8.437 -10.157 4.803 1.00 43.45 H new ATOM 0 HG SER A 25 -8.460 -8.806 2.349 1.00 24.53 H new ATOM 401 N GLY A 26 -4.685 -9.371 4.483 1.00 4.04 N ATOM 402 CA GLY A 26 -3.474 -10.134 4.716 1.00 13.03 C ATOM 403 C GLY A 26 -3.748 -11.613 4.480 1.00 50.12 C ATOM 404 O GLY A 26 -3.548 -12.417 5.392 1.00 3.32 O ATOM 0 H GLY A 26 -4.684 -8.875 3.592 1.00 4.04 H new ATOM 0 HA2 GLY A 26 -2.682 -9.790 4.051 1.00 13.03 H new ATOM 0 HA3 GLY A 26 -3.124 -9.977 5.736 1.00 13.03 H new ATOM 408 N ASN A 27 -4.190 -11.976 3.269 1.00 72.33 N ATOM 409 CA ASN A 27 -4.436 -13.366 2.872 1.00 50.21 C ATOM 410 C ASN A 27 -3.812 -13.653 1.515 1.00 42.14 C ATOM 411 O ASN A 27 -3.482 -12.737 0.766 1.00 54.33 O ATOM 412 CB ASN A 27 -5.934 -13.661 2.733 1.00 30.20 C ATOM 413 CG ASN A 27 -6.751 -13.362 3.968 1.00 43.41 C ATOM 414 OD1 ASN A 27 -6.382 -13.695 5.088 1.00 62.41 O ATOM 415 ND2 ASN A 27 -7.894 -12.736 3.780 1.00 33.11 N ATOM 0 H ASN A 27 -4.389 -11.303 2.529 1.00 72.33 H new ATOM 0 HA ASN A 27 -3.998 -13.988 3.653 1.00 50.21 H new ATOM 0 HB2 ASN A 27 -6.330 -13.078 1.901 1.00 30.20 H new ATOM 0 HB3 ASN A 27 -6.061 -14.712 2.475 1.00 30.20 H new ATOM 0 HD21 ASN A 27 -8.493 -12.518 4.576 1.00 33.11 H new ATOM 0 HD22 ASN A 27 -8.180 -12.469 2.838 1.00 33.11 H new ATOM 422 N GLU A 28 -3.770 -14.931 1.157 1.00 30.42 N ATOM 423 CA GLU A 28 -3.326 -15.493 -0.119 1.00 21.41 C ATOM 424 C GLU A 28 -4.242 -15.125 -1.297 1.00 50.14 C ATOM 425 O GLU A 28 -4.014 -15.561 -2.423 1.00 12.33 O ATOM 426 CB GLU A 28 -3.249 -17.022 0.051 1.00 50.23 C ATOM 427 CG GLU A 28 -4.650 -17.665 0.063 1.00 71.13 C ATOM 428 CD GLU A 28 -4.613 -19.074 0.629 1.00 22.32 C ATOM 429 OE1 GLU A 28 -4.526 -19.217 1.872 1.00 32.42 O ATOM 430 OE2 GLU A 28 -4.676 -20.026 -0.172 1.00 41.11 O ATOM 0 H GLU A 28 -4.069 -15.662 1.802 1.00 30.42 H new ATOM 0 HA GLU A 28 -2.352 -15.070 -0.366 1.00 21.41 H new ATOM 0 HB2 GLU A 28 -2.659 -17.449 -0.760 1.00 50.23 H new ATOM 0 HB3 GLU A 28 -2.732 -17.259 0.981 1.00 50.23 H new ATOM 0 HG2 GLU A 28 -5.328 -17.051 0.657 1.00 71.13 H new ATOM 0 HG3 GLU A 28 -5.048 -17.690 -0.951 1.00 71.13 H new ATOM 437 N ASN A 29 -5.310 -14.377 -1.031 1.00 24.10 N ATOM 438 CA ASN A 29 -6.273 -13.873 -2.000 1.00 73.33 C ATOM 439 C ASN A 29 -6.010 -12.392 -2.285 1.00 44.11 C ATOM 440 O ASN A 29 -6.874 -11.714 -2.832 1.00 54.35 O ATOM 441 CB ASN A 29 -7.692 -14.054 -1.435 1.00 30.41 C ATOM 442 CG ASN A 29 -8.332 -15.408 -1.708 1.00 43.14 C ATOM 443 OD1 ASN A 29 -7.883 -16.198 -2.534 1.00 53.02 O ATOM 444 ND2 ASN A 29 -9.446 -15.663 -1.050 1.00 4.22 N ATOM 0 H ASN A 29 -5.537 -14.092 -0.078 1.00 24.10 H new ATOM 0 HA ASN A 29 -6.174 -14.428 -2.933 1.00 73.33 H new ATOM 0 HB2 ASN A 29 -7.659 -13.897 -0.357 1.00 30.41 H new ATOM 0 HB3 ASN A 29 -8.333 -13.277 -1.851 1.00 30.41 H new ATOM 0 HD21 ASN A 29 -9.953 -16.531 -1.223 1.00 4.22 H new ATOM 0 HD22 ASN A 29 -9.801 -14.992 -0.368 1.00 4.22 H new ATOM 451 N GLU A 30 -4.879 -11.836 -1.854 1.00 74.14 N ATOM 452 CA GLU A 30 -4.545 -10.433 -2.037 1.00 5.23 C ATOM 453 C GLU A 30 -3.072 -10.356 -2.408 1.00 44.44 C ATOM 454 O GLU A 30 -2.303 -11.235 -2.011 1.00 34.32 O ATOM 455 CB GLU A 30 -4.817 -9.647 -0.747 1.00 45.43 C ATOM 456 CG GLU A 30 -6.247 -9.810 -0.207 1.00 13.04 C ATOM 457 CD GLU A 30 -6.472 -8.921 1.009 1.00 64.12 C ATOM 458 OE1 GLU A 30 -5.613 -8.894 1.910 1.00 71.21 O ATOM 459 OE2 GLU A 30 -7.510 -8.217 1.091 1.00 21.25 O ATOM 0 H GLU A 30 -4.159 -12.362 -1.359 1.00 74.14 H new ATOM 0 HA GLU A 30 -5.157 -9.994 -2.825 1.00 5.23 H new ATOM 0 HB2 GLU A 30 -4.111 -9.969 0.019 1.00 45.43 H new ATOM 0 HB3 GLU A 30 -4.627 -8.590 -0.931 1.00 45.43 H new ATOM 0 HG2 GLU A 30 -6.966 -9.556 -0.986 1.00 13.04 H new ATOM 0 HG3 GLU A 30 -6.422 -10.852 0.061 1.00 13.04 H new ATOM 466 N GLU A 31 -2.676 -9.318 -3.146 1.00 24.13 N ATOM 467 CA GLU A 31 -1.306 -9.129 -3.605 1.00 12.21 C ATOM 468 C GLU A 31 -1.016 -7.625 -3.615 1.00 63.31 C ATOM 469 O GLU A 31 -1.948 -6.820 -3.736 1.00 1.44 O ATOM 470 CB GLU A 31 -1.185 -9.797 -4.988 1.00 63.45 C ATOM 471 CG GLU A 31 0.232 -9.997 -5.523 1.00 62.41 C ATOM 472 CD GLU A 31 0.574 -9.003 -6.615 1.00 73.13 C ATOM 473 OE1 GLU A 31 0.259 -9.288 -7.792 1.00 51.24 O ATOM 474 OE2 GLU A 31 1.136 -7.954 -6.254 1.00 13.24 O ATOM 0 H GLU A 31 -3.310 -8.576 -3.444 1.00 24.13 H new ATOM 0 HA GLU A 31 -0.564 -9.591 -2.954 1.00 12.21 H new ATOM 0 HB2 GLU A 31 -1.673 -10.770 -4.941 1.00 63.45 H new ATOM 0 HB3 GLU A 31 -1.740 -9.196 -5.708 1.00 63.45 H new ATOM 0 HG2 GLU A 31 0.946 -9.896 -4.705 1.00 62.41 H new ATOM 0 HG3 GLU A 31 0.333 -11.011 -5.911 1.00 62.41 H new ATOM 481 N ILE A 32 0.251 -7.249 -3.436 1.00 62.13 N ATOM 482 CA ILE A 32 0.730 -5.871 -3.491 1.00 62.20 C ATOM 483 C ILE A 32 2.001 -5.828 -4.334 1.00 41.53 C ATOM 484 O ILE A 32 3.000 -6.420 -3.927 1.00 41.44 O ATOM 485 CB ILE A 32 0.977 -5.323 -2.055 1.00 12.03 C ATOM 486 CG1 ILE A 32 -0.347 -5.041 -1.326 1.00 52.40 C ATOM 487 CG2 ILE A 32 1.737 -3.985 -2.083 1.00 74.32 C ATOM 488 CD1 ILE A 32 -0.878 -6.132 -0.410 1.00 70.34 C ATOM 0 H ILE A 32 0.995 -7.919 -3.242 1.00 62.13 H new ATOM 0 HA ILE A 32 -0.022 -5.232 -3.953 1.00 62.20 H new ATOM 0 HB ILE A 32 1.555 -6.092 -1.543 1.00 12.03 H new ATOM 0 HG12 ILE A 32 -0.221 -4.134 -0.735 1.00 52.40 H new ATOM 0 HG13 ILE A 32 -1.108 -4.829 -2.077 1.00 52.40 H new ATOM 0 HG21 ILE A 32 1.891 -3.633 -1.063 1.00 74.32 H new ATOM 0 HG22 ILE A 32 2.703 -4.125 -2.569 1.00 74.32 H new ATOM 0 HG23 ILE A 32 1.156 -3.248 -2.637 1.00 74.32 H new ATOM 0 HD11 ILE A 32 -1.815 -5.805 0.040 1.00 70.34 H new ATOM 0 HD12 ILE A 32 -1.050 -7.040 -0.988 1.00 70.34 H new ATOM 0 HD13 ILE A 32 -0.150 -6.334 0.375 1.00 70.34 H new ATOM 500 N THR A 33 2.002 -5.037 -5.406 1.00 70.02 N ATOM 501 CA THR A 33 3.160 -4.627 -6.184 1.00 41.24 C ATOM 502 C THR A 33 3.678 -3.288 -5.635 1.00 30.02 C ATOM 503 O THR A 33 3.075 -2.247 -5.906 1.00 11.44 O ATOM 504 CB THR A 33 2.784 -4.475 -7.672 1.00 72.40 C ATOM 505 OG1 THR A 33 1.953 -5.511 -8.149 1.00 2.32 O ATOM 506 CG2 THR A 33 4.052 -4.430 -8.519 1.00 4.23 C ATOM 0 H THR A 33 1.136 -4.643 -5.774 1.00 70.02 H new ATOM 0 HA THR A 33 3.937 -5.387 -6.104 1.00 41.24 H new ATOM 0 HB THR A 33 2.221 -3.545 -7.755 1.00 72.40 H new ATOM 0 HG1 THR A 33 1.749 -5.357 -9.095 1.00 2.32 H new ATOM 0 HG21 THR A 33 3.784 -4.323 -9.570 1.00 4.23 H new ATOM 0 HG22 THR A 33 4.665 -3.582 -8.212 1.00 4.23 H new ATOM 0 HG23 THR A 33 4.615 -5.353 -8.381 1.00 4.23 H new ATOM 514 N VAL A 34 4.783 -3.271 -4.883 1.00 64.00 N ATOM 515 CA VAL A 34 5.427 -2.024 -4.465 1.00 24.23 C ATOM 516 C VAL A 34 6.390 -1.606 -5.559 1.00 23.31 C ATOM 517 O VAL A 34 7.383 -2.301 -5.773 1.00 61.32 O ATOM 518 CB VAL A 34 6.142 -2.179 -3.101 1.00 65.32 C ATOM 519 CG1 VAL A 34 6.914 -0.915 -2.683 1.00 25.43 C ATOM 520 CG2 VAL A 34 5.142 -2.487 -1.981 1.00 30.33 C ATOM 0 H VAL A 34 5.252 -4.113 -4.550 1.00 64.00 H new ATOM 0 HA VAL A 34 4.674 -1.249 -4.321 1.00 24.23 H new ATOM 0 HB VAL A 34 6.842 -3.003 -3.239 1.00 65.32 H new ATOM 0 HG11 VAL A 34 7.394 -1.084 -1.719 1.00 25.43 H new ATOM 0 HG12 VAL A 34 7.673 -0.688 -3.432 1.00 25.43 H new ATOM 0 HG13 VAL A 34 6.222 -0.076 -2.602 1.00 25.43 H new ATOM 0 HG21 VAL A 34 5.675 -2.590 -1.036 1.00 30.33 H new ATOM 0 HG22 VAL A 34 4.420 -1.674 -1.904 1.00 30.33 H new ATOM 0 HG23 VAL A 34 4.619 -3.416 -2.206 1.00 30.33 H new ATOM 530 N THR A 35 6.133 -0.476 -6.219 1.00 14.35 N ATOM 531 CA THR A 35 7.143 0.163 -7.039 1.00 53.54 C ATOM 532 C THR A 35 7.947 1.131 -6.161 1.00 15.32 C ATOM 533 O THR A 35 7.392 1.869 -5.337 1.00 54.52 O ATOM 534 CB THR A 35 6.489 0.802 -8.272 1.00 52.54 C ATOM 535 OG1 THR A 35 5.632 -0.141 -8.883 1.00 13.15 O ATOM 536 CG2 THR A 35 7.524 1.181 -9.334 1.00 33.03 C ATOM 0 H THR A 35 5.235 0.008 -6.197 1.00 14.35 H new ATOM 0 HA THR A 35 7.856 -0.559 -7.437 1.00 53.54 H new ATOM 0 HB THR A 35 5.961 1.692 -7.928 1.00 52.54 H new ATOM 0 HG1 THR A 35 5.210 0.262 -9.670 1.00 13.15 H new ATOM 0 HG21 THR A 35 7.020 1.630 -10.190 1.00 33.03 H new ATOM 0 HG22 THR A 35 8.231 1.896 -8.914 1.00 33.03 H new ATOM 0 HG23 THR A 35 8.059 0.288 -9.656 1.00 33.03 H new ATOM 544 N TYR A 36 9.269 1.137 -6.323 1.00 64.22 N ATOM 545 CA TYR A 36 10.174 2.080 -5.677 1.00 22.11 C ATOM 546 C TYR A 36 11.349 2.387 -6.597 1.00 32.34 C ATOM 547 O TYR A 36 11.543 1.725 -7.610 1.00 62.31 O ATOM 548 CB TYR A 36 10.683 1.537 -4.335 1.00 64.22 C ATOM 549 CG TYR A 36 11.862 0.583 -4.438 1.00 73.01 C ATOM 550 CD1 TYR A 36 11.679 -0.751 -4.851 1.00 12.25 C ATOM 551 CD2 TYR A 36 13.159 1.060 -4.168 1.00 3.44 C ATOM 552 CE1 TYR A 36 12.784 -1.617 -4.952 1.00 52.43 C ATOM 553 CE2 TYR A 36 14.263 0.199 -4.252 1.00 63.31 C ATOM 554 CZ TYR A 36 14.077 -1.149 -4.629 1.00 51.31 C ATOM 555 OH TYR A 36 15.149 -1.987 -4.663 1.00 73.23 O ATOM 0 H TYR A 36 9.751 0.468 -6.923 1.00 64.22 H new ATOM 0 HA TYR A 36 9.620 2.998 -5.479 1.00 22.11 H new ATOM 0 HB2 TYR A 36 10.969 2.378 -3.704 1.00 64.22 H new ATOM 0 HB3 TYR A 36 9.863 1.025 -3.832 1.00 64.22 H new ATOM 0 HD1 TYR A 36 10.689 -1.110 -5.091 1.00 12.25 H new ATOM 0 HD2 TYR A 36 13.305 2.095 -3.895 1.00 3.44 H new ATOM 0 HE1 TYR A 36 12.643 -2.638 -5.276 1.00 52.43 H new ATOM 0 HE2 TYR A 36 15.254 0.566 -4.029 1.00 63.31 H new ATOM 0 HH TYR A 36 15.958 -1.494 -4.413 1.00 73.23 H new ATOM 565 N VAL A 37 12.153 3.381 -6.226 1.00 61.00 N ATOM 566 CA VAL A 37 13.250 3.908 -6.998 1.00 32.21 C ATOM 567 C VAL A 37 14.508 4.076 -6.141 1.00 0.45 C ATOM 568 O VAL A 37 14.471 4.435 -4.960 1.00 14.35 O ATOM 569 CB VAL A 37 12.681 5.062 -7.845 1.00 44.14 C ATOM 570 CG1 VAL A 37 11.692 5.962 -7.102 1.00 73.42 C ATOM 571 CG2 VAL A 37 13.752 5.988 -8.430 1.00 62.11 C ATOM 0 H VAL A 37 12.042 3.858 -5.331 1.00 61.00 H new ATOM 0 HA VAL A 37 13.672 3.234 -7.743 1.00 32.21 H new ATOM 0 HB VAL A 37 12.167 4.522 -8.641 1.00 44.14 H new ATOM 0 HG11 VAL A 37 11.341 6.747 -7.771 1.00 73.42 H new ATOM 0 HG12 VAL A 37 10.843 5.368 -6.763 1.00 73.42 H new ATOM 0 HG13 VAL A 37 12.186 6.413 -6.241 1.00 73.42 H new ATOM 0 HG21 VAL A 37 13.274 6.775 -9.013 1.00 62.11 H new ATOM 0 HG22 VAL A 37 14.328 6.436 -7.620 1.00 62.11 H new ATOM 0 HG23 VAL A 37 14.418 5.413 -9.074 1.00 62.11 H new ATOM 581 N ASN A 38 15.639 3.658 -6.708 1.00 33.31 N ATOM 582 CA ASN A 38 16.929 3.634 -6.030 1.00 14.22 C ATOM 583 C ASN A 38 17.594 5.003 -6.174 1.00 52.30 C ATOM 584 O ASN A 38 16.968 5.951 -6.641 1.00 13.51 O ATOM 585 CB ASN A 38 17.765 2.428 -6.511 1.00 12.15 C ATOM 586 CG ASN A 38 18.477 2.561 -7.839 1.00 72.13 C ATOM 587 OD1 ASN A 38 17.974 2.113 -8.856 1.00 14.12 O ATOM 588 ND2 ASN A 38 19.686 3.088 -7.868 1.00 21.31 N ATOM 0 H ASN A 38 15.682 3.321 -7.670 1.00 33.31 H new ATOM 0 HA ASN A 38 16.817 3.473 -4.958 1.00 14.22 H new ATOM 0 HB2 ASN A 38 18.513 2.210 -5.748 1.00 12.15 H new ATOM 0 HB3 ASN A 38 17.106 1.562 -6.567 1.00 12.15 H new ATOM 0 HD21 ASN A 38 20.206 3.123 -8.745 1.00 21.31 H new ATOM 0 HD22 ASN A 38 20.100 3.461 -7.014 1.00 21.31 H new ATOM 595 N LYS A 39 18.845 5.148 -5.729 1.00 11.41 N ATOM 596 CA LYS A 39 19.576 6.413 -5.864 1.00 14.13 C ATOM 597 C LYS A 39 19.627 6.945 -7.299 1.00 64.22 C ATOM 598 O LYS A 39 19.715 8.159 -7.470 1.00 23.43 O ATOM 599 CB LYS A 39 20.990 6.309 -5.250 1.00 15.51 C ATOM 600 CG LYS A 39 20.942 6.773 -3.791 1.00 34.15 C ATOM 601 CD LYS A 39 22.290 6.832 -3.066 1.00 31.13 C ATOM 602 CE LYS A 39 22.221 7.839 -1.902 1.00 55.14 C ATOM 603 NZ LYS A 39 21.110 7.544 -0.966 1.00 23.25 N ATOM 0 H LYS A 39 19.374 4.405 -5.272 1.00 11.41 H new ATOM 0 HA LYS A 39 19.006 7.150 -5.297 1.00 14.13 H new ATOM 0 HB2 LYS A 39 21.349 5.281 -5.305 1.00 15.51 H new ATOM 0 HB3 LYS A 39 21.691 6.922 -5.816 1.00 15.51 H new ATOM 0 HG2 LYS A 39 20.490 7.764 -3.759 1.00 34.15 H new ATOM 0 HG3 LYS A 39 20.282 6.104 -3.238 1.00 34.15 H new ATOM 0 HD2 LYS A 39 22.552 5.844 -2.687 1.00 31.13 H new ATOM 0 HD3 LYS A 39 23.075 7.124 -3.764 1.00 31.13 H new ATOM 0 HE2 LYS A 39 23.165 7.826 -1.357 1.00 55.14 H new ATOM 0 HE3 LYS A 39 22.098 8.845 -2.302 1.00 55.14 H new ATOM 0 HZ1 LYS A 39 21.185 8.161 -0.132 1.00 23.25 H new ATOM 0 HZ2 LYS A 39 20.201 7.714 -1.442 1.00 23.25 H new ATOM 0 HZ3 LYS A 39 21.163 6.550 -0.666 1.00 23.25 H new ATOM 617 N THR A 40 19.574 6.093 -8.323 1.00 3.22 N ATOM 618 CA THR A 40 19.605 6.548 -9.711 1.00 13.53 C ATOM 619 C THR A 40 18.168 6.717 -10.214 1.00 64.20 C ATOM 620 O THR A 40 17.211 6.406 -9.504 1.00 2.13 O ATOM 621 CB THR A 40 20.467 5.590 -10.555 1.00 41.50 C ATOM 622 OG1 THR A 40 20.035 4.248 -10.448 1.00 64.42 O ATOM 623 CG2 THR A 40 21.919 5.608 -10.070 1.00 33.02 C ATOM 0 H THR A 40 19.509 5.081 -8.215 1.00 3.22 H new ATOM 0 HA THR A 40 20.080 7.525 -9.799 1.00 13.53 H new ATOM 0 HB THR A 40 20.376 5.936 -11.585 1.00 41.50 H new ATOM 0 HG1 THR A 40 19.753 3.924 -11.329 1.00 64.42 H new ATOM 0 HG21 THR A 40 22.514 4.926 -10.677 1.00 33.02 H new ATOM 0 HG22 THR A 40 22.320 6.617 -10.160 1.00 33.02 H new ATOM 0 HG23 THR A 40 21.958 5.294 -9.027 1.00 33.02 H new ATOM 631 N GLY A 41 17.984 7.152 -11.460 1.00 61.11 N ATOM 632 CA GLY A 41 16.675 7.260 -12.092 1.00 31.24 C ATOM 633 C GLY A 41 16.114 5.901 -12.512 1.00 22.14 C ATOM 634 O GLY A 41 15.603 5.774 -13.628 1.00 41.20 O ATOM 0 H GLY A 41 18.752 7.443 -12.065 1.00 61.11 H new ATOM 0 HA2 GLY A 41 15.980 7.739 -11.402 1.00 31.24 H new ATOM 0 HA3 GLY A 41 16.750 7.905 -12.968 1.00 31.24 H new ATOM 638 N TYR A 42 16.242 4.881 -11.661 1.00 21.33 N ATOM 639 CA TYR A 42 15.913 3.494 -11.939 1.00 71.20 C ATOM 640 C TYR A 42 14.965 2.995 -10.865 1.00 62.21 C ATOM 641 O TYR A 42 15.184 3.198 -9.669 1.00 60.30 O ATOM 642 CB TYR A 42 17.185 2.641 -12.032 1.00 64.13 C ATOM 643 CG TYR A 42 18.108 2.963 -13.194 1.00 23.33 C ATOM 644 CD1 TYR A 42 17.600 3.444 -14.414 1.00 32.33 C ATOM 645 CD2 TYR A 42 19.499 2.807 -13.042 1.00 73.14 C ATOM 646 CE1 TYR A 42 18.473 3.846 -15.428 1.00 52.41 C ATOM 647 CE2 TYR A 42 20.381 3.226 -14.054 1.00 54.33 C ATOM 648 CZ TYR A 42 19.864 3.745 -15.259 1.00 42.11 C ATOM 649 OH TYR A 42 20.671 4.130 -16.283 1.00 23.25 O ATOM 0 H TYR A 42 16.596 5.014 -10.714 1.00 21.33 H new ATOM 0 HA TYR A 42 15.417 3.413 -12.906 1.00 71.20 H new ATOM 0 HB2 TYR A 42 17.745 2.754 -11.104 1.00 64.13 H new ATOM 0 HB3 TYR A 42 16.894 1.593 -12.102 1.00 64.13 H new ATOM 0 HD1 TYR A 42 16.533 3.503 -14.567 1.00 32.33 H new ATOM 0 HD2 TYR A 42 19.892 2.362 -12.140 1.00 73.14 H new ATOM 0 HE1 TYR A 42 18.074 4.239 -16.352 1.00 52.41 H new ATOM 0 HE2 TYR A 42 21.449 3.151 -13.909 1.00 54.33 H new ATOM 0 HH TYR A 42 21.608 4.006 -16.025 1.00 23.25 H new ATOM 659 N SER A 43 13.877 2.394 -11.325 1.00 40.42 N ATOM 660 CA SER A 43 12.791 1.901 -10.514 1.00 32.43 C ATOM 661 C SER A 43 12.840 0.377 -10.524 1.00 1.25 C ATOM 662 O SER A 43 13.510 -0.231 -11.365 1.00 75.20 O ATOM 663 CB SER A 43 11.499 2.467 -11.110 1.00 72.30 C ATOM 664 OG SER A 43 10.338 1.957 -10.508 1.00 34.01 O ATOM 0 H SER A 43 13.728 2.233 -12.321 1.00 40.42 H new ATOM 0 HA SER A 43 12.855 2.214 -9.472 1.00 32.43 H new ATOM 0 HB2 SER A 43 11.506 3.552 -11.008 1.00 72.30 H new ATOM 0 HB3 SER A 43 11.473 2.247 -12.177 1.00 72.30 H new ATOM 0 HG SER A 43 10.504 1.803 -9.555 1.00 34.01 H new ATOM 670 N SER A 44 12.092 -0.248 -9.628 1.00 14.44 N ATOM 671 CA SER A 44 11.714 -1.645 -9.696 1.00 62.30 C ATOM 672 C SER A 44 10.330 -1.796 -9.066 1.00 55.21 C ATOM 673 O SER A 44 9.972 -0.998 -8.197 1.00 52.34 O ATOM 674 CB SER A 44 12.724 -2.475 -8.911 1.00 72.33 C ATOM 675 OG SER A 44 14.083 -2.163 -9.199 1.00 54.35 O ATOM 0 H SER A 44 11.719 0.224 -8.804 1.00 14.44 H new ATOM 0 HA SER A 44 11.695 -1.986 -10.731 1.00 62.30 H new ATOM 0 HB2 SER A 44 12.547 -2.330 -7.845 1.00 72.33 H new ATOM 0 HB3 SER A 44 12.552 -3.531 -9.122 1.00 72.33 H new ATOM 0 HG SER A 44 14.671 -2.732 -8.659 1.00 54.35 H new ATOM 681 N SER A 45 9.589 -2.843 -9.427 1.00 42.12 N ATOM 682 CA SER A 45 8.305 -3.189 -8.843 1.00 73.12 C ATOM 683 C SER A 45 8.362 -4.636 -8.350 1.00 70.41 C ATOM 684 O SER A 45 8.805 -5.526 -9.086 1.00 30.02 O ATOM 685 CB SER A 45 7.194 -2.908 -9.860 1.00 53.53 C ATOM 686 OG SER A 45 7.433 -3.354 -11.184 1.00 55.54 O ATOM 0 H SER A 45 9.880 -3.491 -10.158 1.00 42.12 H new ATOM 0 HA SER A 45 8.075 -2.575 -7.972 1.00 73.12 H new ATOM 0 HB2 SER A 45 6.276 -3.373 -9.502 1.00 53.53 H new ATOM 0 HB3 SER A 45 7.017 -1.833 -9.887 1.00 53.53 H new ATOM 0 HG SER A 45 6.665 -3.127 -11.749 1.00 55.54 H new ATOM 692 N VAL A 46 7.952 -4.863 -7.100 1.00 50.44 N ATOM 693 CA VAL A 46 8.046 -6.148 -6.411 1.00 2.24 C ATOM 694 C VAL A 46 6.667 -6.544 -5.887 1.00 41.12 C ATOM 695 O VAL A 46 6.070 -5.789 -5.120 1.00 11.32 O ATOM 696 CB VAL A 46 9.153 -6.079 -5.335 1.00 73.13 C ATOM 697 CG1 VAL A 46 9.006 -4.987 -4.263 1.00 33.02 C ATOM 698 CG2 VAL A 46 9.353 -7.431 -4.640 1.00 24.44 C ATOM 0 H VAL A 46 7.533 -4.134 -6.523 1.00 50.44 H new ATOM 0 HA VAL A 46 8.347 -6.945 -7.091 1.00 2.24 H new ATOM 0 HB VAL A 46 10.030 -5.801 -5.920 1.00 73.13 H new ATOM 0 HG11 VAL A 46 9.844 -5.044 -3.568 1.00 33.02 H new ATOM 0 HG12 VAL A 46 8.996 -4.007 -4.741 1.00 33.02 H new ATOM 0 HG13 VAL A 46 8.073 -5.135 -3.719 1.00 33.02 H new ATOM 0 HG21 VAL A 46 10.139 -7.342 -3.890 1.00 24.44 H new ATOM 0 HG22 VAL A 46 8.424 -7.733 -4.157 1.00 24.44 H new ATOM 0 HG23 VAL A 46 9.638 -8.181 -5.378 1.00 24.44 H new ATOM 708 N SER A 47 6.160 -7.696 -6.329 1.00 70.32 N ATOM 709 CA SER A 47 4.804 -8.180 -6.081 1.00 22.33 C ATOM 710 C SER A 47 4.833 -9.395 -5.147 1.00 3.42 C ATOM 711 O SER A 47 5.679 -10.284 -5.322 1.00 4.20 O ATOM 712 CB SER A 47 4.088 -8.452 -7.417 1.00 51.23 C ATOM 713 OG SER A 47 4.990 -8.656 -8.502 1.00 45.52 O ATOM 0 H SER A 47 6.708 -8.344 -6.894 1.00 70.32 H new ATOM 0 HA SER A 47 4.225 -7.413 -5.567 1.00 22.33 H new ATOM 0 HB2 SER A 47 3.453 -9.331 -7.310 1.00 51.23 H new ATOM 0 HB3 SER A 47 3.433 -7.612 -7.649 1.00 51.23 H new ATOM 0 HG SER A 47 4.482 -8.826 -9.323 1.00 45.52 H new ATOM 719 N ALA A 48 3.938 -9.475 -4.154 1.00 30.00 N ATOM 720 CA ALA A 48 3.864 -10.624 -3.247 1.00 51.32 C ATOM 721 C ALA A 48 2.482 -10.735 -2.615 1.00 45.53 C ATOM 722 O ALA A 48 1.816 -9.718 -2.419 1.00 23.04 O ATOM 723 CB ALA A 48 4.958 -10.553 -2.176 1.00 23.33 C ATOM 0 H ALA A 48 3.249 -8.749 -3.959 1.00 30.00 H new ATOM 0 HA ALA A 48 4.034 -11.525 -3.836 1.00 51.32 H new ATOM 0 HB1 ALA A 48 4.879 -11.418 -1.517 1.00 23.33 H new ATOM 0 HB2 ALA A 48 5.937 -10.550 -2.655 1.00 23.33 H new ATOM 0 HB3 ALA A 48 4.837 -9.640 -1.592 1.00 23.33 H new ATOM 729 N TYR A 49 2.052 -11.967 -2.326 1.00 33.21 N ATOM 730 CA TYR A 49 0.729 -12.242 -1.770 1.00 3.00 C ATOM 731 C TYR A 49 0.672 -11.834 -0.300 1.00 34.20 C ATOM 732 O TYR A 49 1.708 -11.592 0.322 1.00 65.52 O ATOM 733 CB TYR A 49 0.348 -13.727 -1.957 1.00 4.20 C ATOM 734 CG TYR A 49 -0.252 -14.129 -3.297 1.00 30.34 C ATOM 735 CD1 TYR A 49 -0.157 -13.284 -4.415 1.00 21.11 C ATOM 736 CD2 TYR A 49 -0.996 -15.322 -3.398 1.00 1.11 C ATOM 737 CE1 TYR A 49 -0.850 -13.578 -5.598 1.00 41.53 C ATOM 738 CE2 TYR A 49 -1.668 -15.641 -4.594 1.00 71.21 C ATOM 739 CZ TYR A 49 -1.608 -14.762 -5.698 1.00 4.31 C ATOM 740 OH TYR A 49 -2.291 -15.033 -6.843 1.00 50.12 O ATOM 0 H TYR A 49 2.617 -12.804 -2.473 1.00 33.21 H new ATOM 0 HA TYR A 49 -0.003 -11.645 -2.314 1.00 3.00 H new ATOM 0 HB2 TYR A 49 1.242 -14.328 -1.794 1.00 4.20 H new ATOM 0 HB3 TYR A 49 -0.363 -13.994 -1.175 1.00 4.20 H new ATOM 0 HD1 TYR A 49 0.457 -12.397 -4.363 1.00 21.11 H new ATOM 0 HD2 TYR A 49 -1.051 -15.994 -2.555 1.00 1.11 H new ATOM 0 HE1 TYR A 49 -0.803 -12.896 -6.434 1.00 41.53 H new ATOM 0 HE2 TYR A 49 -2.231 -16.560 -4.667 1.00 71.21 H new ATOM 0 HH TYR A 49 -2.761 -15.888 -6.749 1.00 50.12 H new ATOM 750 N GLY A 50 -0.535 -11.727 0.259 1.00 52.01 N ATOM 751 CA GLY A 50 -0.762 -11.136 1.570 1.00 10.11 C ATOM 752 C GLY A 50 -0.872 -12.128 2.703 1.00 74.14 C ATOM 753 O GLY A 50 -0.852 -11.696 3.857 1.00 41.02 O ATOM 0 H GLY A 50 -1.388 -12.053 -0.194 1.00 52.01 H new ATOM 0 HA2 GLY A 50 0.053 -10.446 1.788 1.00 10.11 H new ATOM 0 HA3 GLY A 50 -1.677 -10.546 1.533 1.00 10.11 H new ATOM 757 N ASN A 51 -0.929 -13.427 2.426 1.00 25.23 N ATOM 758 CA ASN A 51 -0.650 -14.420 3.445 1.00 42.45 C ATOM 759 C ASN A 51 0.807 -14.262 3.852 1.00 42.24 C ATOM 760 O ASN A 51 1.673 -14.077 2.997 1.00 11.01 O ATOM 761 CB ASN A 51 -0.896 -15.853 2.943 1.00 41.05 C ATOM 762 CG ASN A 51 -0.040 -16.222 1.731 1.00 53.02 C ATOM 763 OD1 ASN A 51 -0.143 -15.586 0.689 1.00 41.14 O ATOM 764 ND2 ASN A 51 0.794 -17.239 1.832 1.00 13.04 N ATOM 0 H ASN A 51 -1.164 -13.810 1.510 1.00 25.23 H new ATOM 0 HA ASN A 51 -1.321 -14.262 4.289 1.00 42.45 H new ATOM 0 HB2 ASN A 51 -0.691 -16.555 3.752 1.00 41.05 H new ATOM 0 HB3 ASN A 51 -1.949 -15.964 2.684 1.00 41.05 H new ATOM 0 HD21 ASN A 51 1.368 -17.509 1.033 1.00 13.04 H new ATOM 0 HD22 ASN A 51 0.865 -17.755 2.709 1.00 13.04 H new ATOM 771 N ASN A 52 1.096 -14.408 5.143 1.00 34.24 N ATOM 772 CA ASN A 52 2.409 -14.888 5.570 1.00 52.45 C ATOM 773 C ASN A 52 3.484 -13.852 5.245 1.00 50.12 C ATOM 774 O ASN A 52 3.258 -12.652 5.386 1.00 22.22 O ATOM 775 CB ASN A 52 2.685 -16.306 5.032 1.00 4.30 C ATOM 776 CG ASN A 52 1.580 -17.328 5.262 1.00 50.05 C ATOM 777 OD1 ASN A 52 1.390 -18.220 4.441 1.00 45.42 O ATOM 778 ND2 ASN A 52 0.835 -17.271 6.350 1.00 25.33 N ATOM 0 H ASN A 52 0.448 -14.204 5.904 1.00 34.24 H new ATOM 0 HA ASN A 52 2.429 -14.998 6.654 1.00 52.45 H new ATOM 0 HB2 ASN A 52 2.874 -16.237 3.961 1.00 4.30 H new ATOM 0 HB3 ASN A 52 3.600 -16.678 5.494 1.00 4.30 H new ATOM 0 HD21 ASN A 52 0.105 -17.966 6.505 1.00 25.33 H new ATOM 0 HD22 ASN A 52 0.989 -16.531 7.035 1.00 25.33 H new ATOM 785 N ASN A 53 4.707 -14.312 5.037 1.00 70.42 N ATOM 786 CA ASN A 53 5.838 -13.517 4.565 1.00 10.40 C ATOM 787 C ASN A 53 6.205 -13.873 3.120 1.00 11.03 C ATOM 788 O ASN A 53 5.600 -14.761 2.521 1.00 50.42 O ATOM 789 CB ASN A 53 7.034 -13.720 5.498 1.00 31.51 C ATOM 790 CG ASN A 53 7.435 -15.188 5.591 1.00 71.25 C ATOM 791 OD1 ASN A 53 7.986 -15.748 4.657 1.00 72.31 O ATOM 792 ND2 ASN A 53 7.189 -15.851 6.706 1.00 5.12 N ATOM 0 H ASN A 53 4.953 -15.289 5.198 1.00 70.42 H new ATOM 0 HA ASN A 53 5.553 -12.465 4.577 1.00 10.40 H new ATOM 0 HB2 ASN A 53 7.880 -13.134 5.138 1.00 31.51 H new ATOM 0 HB3 ASN A 53 6.787 -13.347 6.492 1.00 31.51 H new ATOM 0 HD21 ASN A 53 7.459 -16.831 6.787 1.00 5.12 H new ATOM 0 HD22 ASN A 53 6.729 -15.383 7.487 1.00 5.12 H new ATOM 799 N ASP A 54 7.223 -13.179 2.600 1.00 33.50 N ATOM 800 CA ASP A 54 7.683 -13.236 1.201 1.00 65.14 C ATOM 801 C ASP A 54 9.155 -13.650 1.103 1.00 2.14 C ATOM 802 O ASP A 54 9.960 -13.353 2.001 1.00 61.53 O ATOM 803 CB ASP A 54 7.490 -11.869 0.512 1.00 65.54 C ATOM 804 CG ASP A 54 8.198 -11.819 -0.853 1.00 51.45 C ATOM 805 OD1 ASP A 54 7.795 -12.573 -1.773 1.00 3.52 O ATOM 806 OD2 ASP A 54 9.224 -11.109 -0.960 1.00 34.34 O ATOM 0 H ASP A 54 7.775 -12.533 3.164 1.00 33.50 H new ATOM 0 HA ASP A 54 7.080 -13.990 0.695 1.00 65.14 H new ATOM 0 HB2 ASP A 54 6.426 -11.675 0.378 1.00 65.54 H new ATOM 0 HB3 ASP A 54 7.880 -11.079 1.154 1.00 65.54 H new ATOM 811 N ASP A 55 9.515 -14.298 -0.006 1.00 11.34 N ATOM 812 CA ASP A 55 10.846 -14.730 -0.401 1.00 70.01 C ATOM 813 C ASP A 55 11.486 -13.655 -1.274 1.00 72.41 C ATOM 814 O ASP A 55 11.232 -13.577 -2.479 1.00 42.11 O ATOM 815 CB ASP A 55 10.816 -16.112 -1.076 1.00 12.23 C ATOM 816 CG ASP A 55 10.990 -17.204 -0.020 1.00 22.21 C ATOM 817 OD1 ASP A 55 12.139 -17.603 0.292 1.00 61.21 O ATOM 818 OD2 ASP A 55 9.983 -17.642 0.573 1.00 25.20 O ATOM 0 H ASP A 55 8.819 -14.553 -0.707 1.00 11.34 H new ATOM 0 HA ASP A 55 11.465 -14.854 0.487 1.00 70.01 H new ATOM 0 HB2 ASP A 55 9.872 -16.250 -1.603 1.00 12.23 H new ATOM 0 HB3 ASP A 55 11.610 -16.182 -1.820 1.00 12.23 H new ATOM 823 N PHE A 56 12.291 -12.818 -0.617 1.00 4.52 N ATOM 824 CA PHE A 56 13.164 -11.782 -1.156 1.00 61.44 C ATOM 825 C PHE A 56 14.127 -12.262 -2.260 1.00 14.10 C ATOM 826 O PHE A 56 14.222 -13.440 -2.589 1.00 21.02 O ATOM 827 CB PHE A 56 13.939 -11.125 0.007 1.00 54.13 C ATOM 828 CG PHE A 56 15.186 -11.876 0.422 1.00 12.44 C ATOM 829 CD1 PHE A 56 16.397 -11.631 -0.251 1.00 30.22 C ATOM 830 CD2 PHE A 56 15.115 -12.891 1.391 1.00 61.14 C ATOM 831 CE1 PHE A 56 17.513 -12.444 -0.011 1.00 24.21 C ATOM 832 CE2 PHE A 56 16.242 -13.689 1.645 1.00 53.33 C ATOM 833 CZ PHE A 56 17.433 -13.487 0.928 1.00 41.43 C ATOM 0 H PHE A 56 12.351 -12.855 0.401 1.00 4.52 H new ATOM 0 HA PHE A 56 12.521 -11.055 -1.652 1.00 61.44 H new ATOM 0 HB2 PHE A 56 14.218 -10.112 -0.283 1.00 54.13 H new ATOM 0 HB3 PHE A 56 13.276 -11.039 0.868 1.00 54.13 H new ATOM 0 HD1 PHE A 56 16.467 -10.814 -0.954 1.00 30.22 H new ATOM 0 HD2 PHE A 56 14.198 -13.056 1.938 1.00 61.14 H new ATOM 0 HE1 PHE A 56 18.434 -12.269 -0.547 1.00 24.21 H new ATOM 0 HE2 PHE A 56 16.193 -14.463 2.396 1.00 53.33 H new ATOM 0 HZ PHE A 56 18.284 -14.130 1.098 1.00 41.43 H new ATOM 843 N SER A 57 14.913 -11.319 -2.782 1.00 5.10 N ATOM 844 CA SER A 57 15.907 -11.484 -3.828 1.00 71.34 C ATOM 845 C SER A 57 17.184 -10.652 -3.569 1.00 72.24 C ATOM 846 O SER A 57 17.129 -9.652 -2.843 1.00 62.22 O ATOM 847 CB SER A 57 15.204 -10.881 -5.011 1.00 24.30 C ATOM 848 OG SER A 57 15.850 -11.175 -6.230 1.00 30.02 O ATOM 0 H SER A 57 14.863 -10.353 -2.457 1.00 5.10 H new ATOM 0 HA SER A 57 16.228 -12.521 -3.927 1.00 71.34 H new ATOM 0 HB2 SER A 57 14.179 -11.251 -5.048 1.00 24.30 H new ATOM 0 HB3 SER A 57 15.148 -9.800 -4.884 1.00 24.30 H new ATOM 0 HG SER A 57 15.356 -10.764 -6.970 1.00 30.02 H new ATOM 854 N SER A 58 18.294 -11.003 -4.235 1.00 3.41 N ATOM 855 CA SER A 58 19.634 -10.389 -4.186 1.00 51.51 C ATOM 856 C SER A 58 19.712 -8.940 -4.743 1.00 51.54 C ATOM 857 O SER A 58 20.730 -8.530 -5.319 1.00 31.34 O ATOM 858 CB SER A 58 20.595 -11.350 -4.921 1.00 23.23 C ATOM 859 OG SER A 58 21.966 -11.128 -4.624 1.00 2.11 O ATOM 0 H SER A 58 18.278 -11.794 -4.879 1.00 3.41 H new ATOM 0 HA SER A 58 19.919 -10.261 -3.142 1.00 51.51 H new ATOM 0 HB2 SER A 58 20.338 -12.376 -4.659 1.00 23.23 H new ATOM 0 HB3 SER A 58 20.445 -11.248 -5.996 1.00 23.23 H new ATOM 0 HG SER A 58 22.175 -10.177 -4.737 1.00 2.11 H new ATOM 865 N THR A 59 18.650 -8.147 -4.647 1.00 45.44 N ATOM 866 CA THR A 59 18.619 -6.740 -5.035 1.00 70.31 C ATOM 867 C THR A 59 19.293 -5.882 -3.943 1.00 14.44 C ATOM 868 O THR A 59 19.222 -6.208 -2.752 1.00 3.52 O ATOM 869 CB THR A 59 17.165 -6.310 -5.330 1.00 4.34 C ATOM 870 OG1 THR A 59 16.242 -7.339 -5.021 1.00 71.04 O ATOM 871 CG2 THR A 59 16.980 -5.955 -6.808 1.00 53.53 C ATOM 0 H THR A 59 17.756 -8.477 -4.284 1.00 45.44 H new ATOM 0 HA THR A 59 19.186 -6.588 -5.953 1.00 70.31 H new ATOM 0 HB THR A 59 16.975 -5.439 -4.703 1.00 4.34 H new ATOM 0 HG1 THR A 59 15.544 -7.370 -5.708 1.00 71.04 H new ATOM 0 HG21 THR A 59 15.947 -5.656 -6.984 1.00 53.53 H new ATOM 0 HG22 THR A 59 17.645 -5.132 -7.071 1.00 53.53 H new ATOM 0 HG23 THR A 59 17.217 -6.823 -7.423 1.00 53.53 H new ATOM 879 N PRO A 60 19.973 -4.782 -4.314 1.00 23.34 N ATOM 880 CA PRO A 60 20.822 -4.015 -3.407 1.00 41.42 C ATOM 881 C PRO A 60 20.017 -3.090 -2.491 1.00 62.33 C ATOM 882 O PRO A 60 18.864 -2.765 -2.768 1.00 14.33 O ATOM 883 CB PRO A 60 21.734 -3.198 -4.328 1.00 25.43 C ATOM 884 CG PRO A 60 20.860 -2.953 -5.552 1.00 10.54 C ATOM 885 CD PRO A 60 20.081 -4.254 -5.661 1.00 73.32 C ATOM 0 HA PRO A 60 21.373 -4.674 -2.736 1.00 41.42 H new ATOM 0 HB2 PRO A 60 22.045 -2.263 -3.861 1.00 25.43 H new ATOM 0 HB3 PRO A 60 22.642 -3.744 -4.584 1.00 25.43 H new ATOM 0 HG2 PRO A 60 20.201 -2.095 -5.416 1.00 10.54 H new ATOM 0 HG3 PRO A 60 21.455 -2.760 -6.444 1.00 10.54 H new ATOM 0 HD2 PRO A 60 19.094 -4.081 -6.090 1.00 73.32 H new ATOM 0 HD3 PRO A 60 20.594 -4.960 -6.315 1.00 73.32 H new ATOM 893 N SER A 61 20.657 -2.563 -1.449 1.00 63.21 N ATOM 894 CA SER A 61 20.160 -1.553 -0.525 1.00 71.31 C ATOM 895 C SER A 61 20.425 -0.154 -1.106 1.00 64.13 C ATOM 896 O SER A 61 20.798 0.783 -0.402 1.00 1.42 O ATOM 897 CB SER A 61 20.854 -1.755 0.828 1.00 73.35 C ATOM 898 OG SER A 61 20.730 -3.094 1.292 1.00 30.11 O ATOM 0 H SER A 61 21.606 -2.854 -1.214 1.00 63.21 H new ATOM 0 HA SER A 61 19.084 -1.647 -0.380 1.00 71.31 H new ATOM 0 HB2 SER A 61 21.909 -1.498 0.737 1.00 73.35 H new ATOM 0 HB3 SER A 61 20.423 -1.075 1.562 1.00 73.35 H new ATOM 0 HG SER A 61 19.944 -3.167 1.873 1.00 30.11 H new ATOM 904 N ASN A 62 20.268 0.002 -2.423 1.00 53.54 N ATOM 905 CA ASN A 62 20.409 1.291 -3.097 1.00 1.24 C ATOM 906 C ASN A 62 19.126 2.125 -2.979 1.00 4.14 C ATOM 907 O ASN A 62 19.043 3.161 -3.646 1.00 62.00 O ATOM 908 CB ASN A 62 20.822 1.097 -4.573 1.00 42.10 C ATOM 909 CG ASN A 62 22.288 0.791 -4.767 1.00 32.45 C ATOM 910 OD1 ASN A 62 23.139 1.104 -3.947 1.00 75.01 O ATOM 911 ND2 ASN A 62 22.622 0.225 -5.903 1.00 11.23 N ATOM 0 H ASN A 62 20.039 -0.767 -3.053 1.00 53.54 H new ATOM 0 HA ASN A 62 21.204 1.846 -2.598 1.00 1.24 H new ATOM 0 HB2 ASN A 62 20.233 0.286 -5.001 1.00 42.10 H new ATOM 0 HB3 ASN A 62 20.573 2.000 -5.131 1.00 42.10 H new ATOM 0 HD21 ASN A 62 23.603 0.040 -6.112 1.00 11.23 H new ATOM 0 HD22 ASN A 62 21.900 -0.030 -6.577 1.00 11.23 H new ATOM 918 N PHE A 63 18.119 1.681 -2.207 1.00 3.32 N ATOM 919 CA PHE A 63 16.861 2.412 -2.017 1.00 31.25 C ATOM 920 C PHE A 63 17.127 3.889 -1.702 1.00 41.30 C ATOM 921 O PHE A 63 18.045 4.205 -0.937 1.00 43.44 O ATOM 922 CB PHE A 63 16.032 1.751 -0.901 1.00 10.44 C ATOM 923 CG PHE A 63 14.938 2.629 -0.316 1.00 50.12 C ATOM 924 CD1 PHE A 63 15.248 3.547 0.708 1.00 74.30 C ATOM 925 CD2 PHE A 63 13.620 2.551 -0.800 1.00 23.25 C ATOM 926 CE1 PHE A 63 14.259 4.402 1.220 1.00 11.25 C ATOM 927 CE2 PHE A 63 12.630 3.399 -0.280 1.00 13.54 C ATOM 928 CZ PHE A 63 12.951 4.336 0.718 1.00 10.21 C ATOM 0 H PHE A 63 18.159 0.799 -1.696 1.00 3.32 H new ATOM 0 HA PHE A 63 16.291 2.371 -2.945 1.00 31.25 H new ATOM 0 HB2 PHE A 63 15.577 0.842 -1.295 1.00 10.44 H new ATOM 0 HB3 PHE A 63 16.705 1.449 -0.098 1.00 10.44 H new ATOM 0 HD1 PHE A 63 16.253 3.593 1.101 1.00 74.30 H new ATOM 0 HD2 PHE A 63 13.370 1.838 -1.572 1.00 23.25 H new ATOM 0 HE1 PHE A 63 14.505 5.109 1.999 1.00 11.25 H new ATOM 0 HE2 PHE A 63 11.617 3.332 -0.648 1.00 13.54 H new ATOM 0 HZ PHE A 63 12.192 5.004 1.097 1.00 10.21 H new ATOM 938 N SER A 64 16.316 4.785 -2.278 1.00 51.11 N ATOM 939 CA SER A 64 16.418 6.212 -1.996 1.00 34.22 C ATOM 940 C SER A 64 15.111 6.979 -2.236 1.00 62.20 C ATOM 941 O SER A 64 15.053 8.167 -1.907 1.00 20.44 O ATOM 942 CB SER A 64 17.547 6.785 -2.864 1.00 53.33 C ATOM 943 OG SER A 64 18.281 7.804 -2.198 1.00 64.13 O ATOM 0 H SER A 64 15.582 4.541 -2.943 1.00 51.11 H new ATOM 0 HA SER A 64 16.634 6.334 -0.935 1.00 34.22 H new ATOM 0 HB2 SER A 64 18.225 5.981 -3.150 1.00 53.33 H new ATOM 0 HB3 SER A 64 17.125 7.188 -3.784 1.00 53.33 H new ATOM 0 HG SER A 64 17.659 8.431 -1.774 1.00 64.13 H new ATOM 949 N LYS A 65 14.083 6.386 -2.854 1.00 75.23 N ATOM 950 CA LYS A 65 12.830 7.046 -3.155 1.00 53.50 C ATOM 951 C LYS A 65 11.742 5.995 -3.364 1.00 23.41 C ATOM 952 O LYS A 65 12.043 4.802 -3.476 1.00 60.40 O ATOM 953 CB LYS A 65 13.042 7.933 -4.395 1.00 53.11 C ATOM 954 CG LYS A 65 11.887 8.926 -4.506 1.00 43.21 C ATOM 955 CD LYS A 65 12.181 10.170 -5.337 1.00 60.22 C ATOM 956 CE LYS A 65 12.050 9.892 -6.831 1.00 42.40 C ATOM 957 NZ LYS A 65 11.650 11.121 -7.532 1.00 40.52 N ATOM 0 H LYS A 65 14.110 5.414 -3.161 1.00 75.23 H new ATOM 0 HA LYS A 65 12.504 7.682 -2.332 1.00 53.50 H new ATOM 0 HB2 LYS A 65 13.990 8.466 -4.318 1.00 53.11 H new ATOM 0 HB3 LYS A 65 13.095 7.317 -5.293 1.00 53.11 H new ATOM 0 HG2 LYS A 65 11.028 8.413 -4.939 1.00 43.21 H new ATOM 0 HG3 LYS A 65 11.599 9.238 -3.502 1.00 43.21 H new ATOM 0 HD2 LYS A 65 11.495 10.968 -5.053 1.00 60.22 H new ATOM 0 HD3 LYS A 65 13.189 10.524 -5.119 1.00 60.22 H new ATOM 0 HE2 LYS A 65 12.998 9.528 -7.227 1.00 42.40 H new ATOM 0 HE3 LYS A 65 11.312 9.108 -7.001 1.00 42.40 H new ATOM 0 HZ1 LYS A 65 11.562 10.927 -8.550 1.00 40.52 H new ATOM 0 HZ2 LYS A 65 10.735 11.450 -7.162 1.00 40.52 H new ATOM 0 HZ3 LYS A 65 12.369 11.857 -7.381 1.00 40.52 H new ATOM 971 N LEU A 66 10.481 6.412 -3.445 1.00 74.13 N ATOM 972 CA LEU A 66 9.356 5.536 -3.698 1.00 14.21 C ATOM 973 C LEU A 66 8.762 5.863 -5.061 1.00 73.11 C ATOM 974 O LEU A 66 9.098 6.854 -5.710 1.00 4.43 O ATOM 975 CB LEU A 66 8.307 5.676 -2.579 1.00 72.23 C ATOM 976 CG LEU A 66 8.630 4.966 -1.254 1.00 71.00 C ATOM 977 CD1 LEU A 66 8.897 3.464 -1.418 1.00 71.00 C ATOM 978 CD2 LEU A 66 9.760 5.622 -0.457 1.00 64.41 C ATOM 0 H LEU A 66 10.214 7.390 -3.333 1.00 74.13 H new ATOM 0 HA LEU A 66 9.691 4.499 -3.705 1.00 14.21 H new ATOM 0 HB2 LEU A 66 8.165 6.737 -2.373 1.00 72.23 H new ATOM 0 HB3 LEU A 66 7.357 5.293 -2.950 1.00 72.23 H new ATOM 0 HG LEU A 66 7.716 5.081 -0.671 1.00 71.00 H new ATOM 0 HD11 LEU A 66 9.118 3.025 -0.445 1.00 71.00 H new ATOM 0 HD12 LEU A 66 8.016 2.982 -1.841 1.00 71.00 H new ATOM 0 HD13 LEU A 66 9.747 3.316 -2.084 1.00 71.00 H new ATOM 0 HD21 LEU A 66 9.928 5.063 0.464 1.00 64.41 H new ATOM 0 HD22 LEU A 66 10.673 5.622 -1.053 1.00 64.41 H new ATOM 0 HD23 LEU A 66 9.485 6.648 -0.214 1.00 64.41 H new ATOM 990 N LYS A 67 7.881 4.977 -5.496 1.00 75.21 N ATOM 991 CA LYS A 67 6.941 5.165 -6.577 1.00 2.13 C ATOM 992 C LYS A 67 5.634 4.579 -6.057 1.00 60.43 C ATOM 993 O LYS A 67 5.464 4.332 -4.860 1.00 44.30 O ATOM 994 CB LYS A 67 7.471 4.515 -7.876 1.00 2.12 C ATOM 995 CG LYS A 67 8.115 5.555 -8.811 1.00 11.53 C ATOM 996 CD LYS A 67 8.956 4.924 -9.926 1.00 41.10 C ATOM 997 CE LYS A 67 8.106 4.138 -10.934 1.00 31.04 C ATOM 998 NZ LYS A 67 8.004 4.795 -12.249 1.00 40.11 N ATOM 0 H LYS A 67 7.802 4.052 -5.074 1.00 75.21 H new ATOM 0 HA LYS A 67 6.790 6.208 -6.855 1.00 2.13 H new ATOM 0 HB2 LYS A 67 8.203 3.747 -7.626 1.00 2.12 H new ATOM 0 HB3 LYS A 67 6.652 4.017 -8.395 1.00 2.12 H new ATOM 0 HG2 LYS A 67 7.332 6.167 -9.258 1.00 11.53 H new ATOM 0 HG3 LYS A 67 8.745 6.222 -8.223 1.00 11.53 H new ATOM 0 HD2 LYS A 67 9.503 5.707 -10.451 1.00 41.10 H new ATOM 0 HD3 LYS A 67 9.697 4.258 -9.484 1.00 41.10 H new ATOM 0 HE2 LYS A 67 8.536 3.145 -11.064 1.00 31.04 H new ATOM 0 HE3 LYS A 67 7.105 4.001 -10.526 1.00 31.04 H new ATOM 0 HZ1 LYS A 67 7.418 4.215 -12.883 1.00 40.11 H new ATOM 0 HZ2 LYS A 67 7.568 5.732 -12.136 1.00 40.11 H new ATOM 0 HZ3 LYS A 67 8.954 4.902 -12.658 1.00 40.11 H new ATOM 1012 N GLU A 68 4.690 4.441 -6.958 1.00 15.54 N ATOM 1013 CA GLU A 68 3.345 3.966 -6.730 1.00 23.42 C ATOM 1014 C GLU A 68 3.264 2.509 -6.244 1.00 4.43 C ATOM 1015 O GLU A 68 4.269 1.811 -6.087 1.00 71.42 O ATOM 1016 CB GLU A 68 2.605 4.163 -8.048 1.00 60.22 C ATOM 1017 CG GLU A 68 3.148 3.248 -9.157 1.00 55.52 C ATOM 1018 CD GLU A 68 3.787 4.003 -10.332 1.00 11.13 C ATOM 1019 OE1 GLU A 68 3.301 5.076 -10.761 1.00 74.21 O ATOM 1020 OE2 GLU A 68 4.831 3.522 -10.831 1.00 75.33 O ATOM 0 H GLU A 68 4.853 4.674 -7.938 1.00 15.54 H new ATOM 0 HA GLU A 68 2.892 4.530 -5.915 1.00 23.42 H new ATOM 0 HB2 GLU A 68 1.544 3.963 -7.901 1.00 60.22 H new ATOM 0 HB3 GLU A 68 2.693 5.203 -8.361 1.00 60.22 H new ATOM 0 HG2 GLU A 68 3.888 2.573 -8.727 1.00 55.52 H new ATOM 0 HG3 GLU A 68 2.334 2.630 -9.535 1.00 55.52 H new ATOM 1027 N ILE A 69 2.032 2.052 -6.024 1.00 43.44 N ATOM 1028 CA ILE A 69 1.689 0.708 -5.592 1.00 14.35 C ATOM 1029 C ILE A 69 0.525 0.240 -6.458 1.00 20.01 C ATOM 1030 O ILE A 69 -0.432 0.983 -6.691 1.00 12.21 O ATOM 1031 CB ILE A 69 1.304 0.661 -4.102 1.00 1.23 C ATOM 1032 CG1 ILE A 69 2.283 1.460 -3.225 1.00 61.11 C ATOM 1033 CG2 ILE A 69 1.272 -0.781 -3.587 1.00 64.40 C ATOM 1034 CD1 ILE A 69 1.813 2.882 -2.931 1.00 1.45 C ATOM 0 H ILE A 69 1.210 2.642 -6.150 1.00 43.44 H new ATOM 0 HA ILE A 69 2.554 0.054 -5.706 1.00 14.35 H new ATOM 0 HB ILE A 69 0.313 1.109 -4.032 1.00 1.23 H new ATOM 0 HG12 ILE A 69 2.429 0.932 -2.283 1.00 61.11 H new ATOM 0 HG13 ILE A 69 3.253 1.501 -3.721 1.00 61.11 H new ATOM 0 HG21 ILE A 69 0.997 -0.785 -2.532 1.00 64.40 H new ATOM 0 HG22 ILE A 69 0.539 -1.354 -4.155 1.00 64.40 H new ATOM 0 HG23 ILE A 69 2.257 -1.232 -3.707 1.00 64.40 H new ATOM 0 HD11 ILE A 69 2.551 3.388 -2.308 1.00 1.45 H new ATOM 0 HD12 ILE A 69 1.694 3.427 -3.868 1.00 1.45 H new ATOM 0 HD13 ILE A 69 0.858 2.848 -2.407 1.00 1.45 H new ATOM 1046 N ASP A 70 0.576 -1.003 -6.909 1.00 4.54 N ATOM 1047 CA ASP A 70 -0.579 -1.686 -7.466 1.00 71.04 C ATOM 1048 C ASP A 70 -0.985 -2.738 -6.444 1.00 5.45 C ATOM 1049 O ASP A 70 -0.120 -3.284 -5.763 1.00 11.33 O ATOM 1050 CB ASP A 70 -0.236 -2.264 -8.842 1.00 43.10 C ATOM 1051 CG ASP A 70 -0.288 -1.173 -9.902 1.00 61.34 C ATOM 1052 OD1 ASP A 70 -1.398 -0.693 -10.213 1.00 20.13 O ATOM 1053 OD2 ASP A 70 0.793 -0.740 -10.367 1.00 41.10 O ATOM 0 H ASP A 70 1.425 -1.569 -6.899 1.00 4.54 H new ATOM 0 HA ASP A 70 -1.421 -1.016 -7.641 1.00 71.04 H new ATOM 0 HB2 ASP A 70 0.758 -2.711 -8.819 1.00 43.10 H new ATOM 0 HB3 ASP A 70 -0.937 -3.060 -9.095 1.00 43.10 H new ATOM 1058 N LEU A 71 -2.286 -2.970 -6.284 1.00 52.11 N ATOM 1059 CA LEU A 71 -2.861 -3.979 -5.395 1.00 22.43 C ATOM 1060 C LEU A 71 -3.678 -4.965 -6.222 1.00 3.44 C ATOM 1061 O LEU A 71 -4.166 -4.609 -7.297 1.00 73.04 O ATOM 1062 CB LEU A 71 -3.799 -3.293 -4.378 1.00 5.34 C ATOM 1063 CG LEU A 71 -3.223 -3.091 -2.971 1.00 3.42 C ATOM 1064 CD1 LEU A 71 -1.912 -2.299 -2.981 1.00 30.45 C ATOM 1065 CD2 LEU A 71 -4.265 -2.344 -2.132 1.00 74.42 C ATOM 0 H LEU A 71 -2.997 -2.440 -6.789 1.00 52.11 H new ATOM 0 HA LEU A 71 -2.060 -4.499 -4.870 1.00 22.43 H new ATOM 0 HB2 LEU A 71 -4.086 -2.320 -4.776 1.00 5.34 H new ATOM 0 HB3 LEU A 71 -4.710 -3.885 -4.296 1.00 5.34 H new ATOM 0 HG LEU A 71 -2.999 -4.071 -2.549 1.00 3.42 H new ATOM 0 HD11 LEU A 71 -1.548 -2.185 -1.960 1.00 30.45 H new ATOM 0 HD12 LEU A 71 -1.169 -2.833 -3.574 1.00 30.45 H new ATOM 0 HD13 LEU A 71 -2.085 -1.315 -3.417 1.00 30.45 H new ATOM 0 HD21 LEU A 71 -3.878 -2.188 -1.125 1.00 74.42 H new ATOM 0 HD22 LEU A 71 -4.479 -1.379 -2.592 1.00 74.42 H new ATOM 0 HD23 LEU A 71 -5.181 -2.933 -2.081 1.00 74.42 H new ATOM 1077 N LYS A 72 -3.972 -6.133 -5.651 1.00 70.13 N ATOM 1078 CA LYS A 72 -5.052 -7.022 -6.075 1.00 2.15 C ATOM 1079 C LYS A 72 -5.736 -7.617 -4.856 1.00 3.34 C ATOM 1080 O LYS A 72 -5.135 -7.711 -3.783 1.00 62.20 O ATOM 1081 CB LYS A 72 -4.489 -8.165 -6.922 1.00 24.03 C ATOM 1082 CG LYS A 72 -4.191 -7.781 -8.367 1.00 1.41 C ATOM 1083 CD LYS A 72 -2.694 -7.757 -8.688 1.00 53.45 C ATOM 1084 CE LYS A 72 -2.482 -8.236 -10.119 1.00 51.11 C ATOM 1085 NZ LYS A 72 -2.699 -9.690 -10.273 1.00 33.40 N ATOM 0 H LYS A 72 -3.448 -6.497 -4.855 1.00 70.13 H new ATOM 0 HA LYS A 72 -5.767 -6.445 -6.662 1.00 2.15 H new ATOM 0 HB2 LYS A 72 -3.573 -8.529 -6.458 1.00 24.03 H new ATOM 0 HB3 LYS A 72 -5.200 -8.991 -6.916 1.00 24.03 H new ATOM 0 HG2 LYS A 72 -4.688 -8.486 -9.033 1.00 1.41 H new ATOM 0 HG3 LYS A 72 -4.615 -6.798 -8.570 1.00 1.41 H new ATOM 0 HD2 LYS A 72 -2.300 -6.748 -8.567 1.00 53.45 H new ATOM 0 HD3 LYS A 72 -2.150 -8.397 -7.993 1.00 53.45 H new ATOM 0 HE2 LYS A 72 -3.161 -7.699 -10.782 1.00 51.11 H new ATOM 0 HE3 LYS A 72 -1.468 -7.989 -10.434 1.00 51.11 H new ATOM 0 HZ1 LYS A 72 -2.202 -10.027 -11.122 1.00 33.40 H new ATOM 0 HZ2 LYS A 72 -2.331 -10.186 -9.436 1.00 33.40 H new ATOM 0 HZ3 LYS A 72 -3.717 -9.881 -10.369 1.00 33.40 H new ATOM 1099 N LYS A 73 -6.986 -8.049 -5.030 1.00 43.32 N ATOM 1100 CA LYS A 73 -7.765 -8.823 -4.071 1.00 64.20 C ATOM 1101 C LYS A 73 -8.719 -9.737 -4.822 1.00 22.42 C ATOM 1102 O LYS A 73 -9.121 -9.409 -5.942 1.00 54.51 O ATOM 1103 CB LYS A 73 -8.611 -7.918 -3.173 1.00 72.54 C ATOM 1104 CG LYS A 73 -7.788 -6.858 -2.452 1.00 14.42 C ATOM 1105 CD LYS A 73 -8.683 -6.042 -1.526 1.00 33.31 C ATOM 1106 CE LYS A 73 -8.239 -4.587 -1.547 1.00 14.32 C ATOM 1107 NZ LYS A 73 -8.766 -3.896 -2.736 1.00 41.41 N ATOM 0 H LYS A 73 -7.505 -7.857 -5.887 1.00 43.32 H new ATOM 0 HA LYS A 73 -7.063 -9.388 -3.458 1.00 64.20 H new ATOM 0 HB2 LYS A 73 -9.375 -7.428 -3.777 1.00 72.54 H new ATOM 0 HB3 LYS A 73 -9.131 -8.530 -2.436 1.00 72.54 H new ATOM 0 HG2 LYS A 73 -6.993 -7.332 -1.877 1.00 14.42 H new ATOM 0 HG3 LYS A 73 -7.308 -6.202 -3.179 1.00 14.42 H new ATOM 0 HD2 LYS A 73 -9.723 -6.121 -1.844 1.00 33.31 H new ATOM 0 HD3 LYS A 73 -8.630 -6.435 -0.511 1.00 33.31 H new ATOM 0 HE2 LYS A 73 -8.586 -4.083 -0.645 1.00 14.32 H new ATOM 0 HE3 LYS A 73 -7.150 -4.534 -1.543 1.00 14.32 H new ATOM 0 HZ1 LYS A 73 -8.143 -3.099 -2.979 1.00 41.41 H new ATOM 0 HZ2 LYS A 73 -8.806 -4.561 -3.535 1.00 41.41 H new ATOM 0 HZ3 LYS A 73 -9.722 -3.539 -2.535 1.00 41.41 H new ATOM 1121 N ASP A 74 -9.171 -10.784 -4.142 1.00 2.20 N ATOM 1122 CA ASP A 74 -10.052 -11.824 -4.651 1.00 1.04 C ATOM 1123 C ASP A 74 -11.300 -11.933 -3.771 1.00 34.20 C ATOM 1124 O ASP A 74 -11.522 -11.123 -2.859 1.00 63.12 O ATOM 1125 CB ASP A 74 -9.287 -13.152 -4.705 1.00 63.33 C ATOM 1126 CG ASP A 74 -9.758 -13.988 -5.881 1.00 23.21 C ATOM 1127 OD1 ASP A 74 -10.761 -14.717 -5.723 1.00 2.33 O ATOM 1128 OD2 ASP A 74 -9.135 -13.910 -6.960 1.00 23.43 O ATOM 0 H ASP A 74 -8.917 -10.937 -3.166 1.00 2.20 H new ATOM 0 HA ASP A 74 -10.380 -11.572 -5.659 1.00 1.04 H new ATOM 0 HB2 ASP A 74 -8.218 -12.959 -4.793 1.00 63.33 H new ATOM 0 HB3 ASP A 74 -9.436 -13.703 -3.776 1.00 63.33 H new ATOM 1133 N ASN A 75 -12.142 -12.938 -4.008 1.00 22.52 N ATOM 1134 CA ASN A 75 -13.308 -13.246 -3.183 1.00 65.24 C ATOM 1135 C ASN A 75 -12.865 -13.933 -1.895 1.00 22.43 C ATOM 1136 O ASN A 75 -13.043 -15.139 -1.722 1.00 61.34 O ATOM 1137 CB ASN A 75 -14.313 -14.128 -3.924 1.00 72.51 C ATOM 1138 CG ASN A 75 -14.944 -13.497 -5.151 1.00 10.14 C ATOM 1139 OD1 ASN A 75 -15.130 -14.149 -6.176 1.00 12.44 O ATOM 1140 ND2 ASN A 75 -15.344 -12.238 -5.052 1.00 73.51 N ATOM 0 H ASN A 75 -12.029 -13.575 -4.797 1.00 22.52 H new ATOM 0 HA ASN A 75 -13.805 -12.305 -2.947 1.00 65.24 H new ATOM 0 HB2 ASN A 75 -13.812 -15.048 -4.225 1.00 72.51 H new ATOM 0 HB3 ASN A 75 -15.106 -14.409 -3.231 1.00 72.51 H new ATOM 0 HD21 ASN A 75 -15.817 -11.790 -5.837 1.00 73.51 H new ATOM 0 HD22 ASN A 75 -15.179 -11.717 -4.191 1.00 73.51 H new ATOM 1147 N VAL A 76 -12.303 -13.155 -0.975 1.00 45.21 N ATOM 1148 CA VAL A 76 -11.912 -13.655 0.332 1.00 13.42 C ATOM 1149 C VAL A 76 -13.122 -14.277 1.060 1.00 2.44 C ATOM 1150 O VAL A 76 -14.260 -13.838 0.834 1.00 4.13 O ATOM 1151 CB VAL A 76 -11.175 -12.565 1.137 1.00 54.24 C ATOM 1152 CG1 VAL A 76 -10.214 -11.704 0.300 1.00 1.23 C ATOM 1153 CG2 VAL A 76 -12.138 -11.619 1.864 1.00 41.35 C ATOM 0 H VAL A 76 -12.108 -12.164 -1.117 1.00 45.21 H new ATOM 0 HA VAL A 76 -11.192 -14.465 0.214 1.00 13.42 H new ATOM 0 HB VAL A 76 -10.590 -13.137 1.857 1.00 54.24 H new ATOM 0 HG11 VAL A 76 -9.737 -10.963 0.941 1.00 1.23 H new ATOM 0 HG12 VAL A 76 -9.451 -12.341 -0.148 1.00 1.23 H new ATOM 0 HG13 VAL A 76 -10.772 -11.197 -0.488 1.00 1.23 H new ATOM 0 HG21 VAL A 76 -11.567 -10.872 2.415 1.00 41.35 H new ATOM 0 HG22 VAL A 76 -12.779 -11.122 1.136 1.00 41.35 H new ATOM 0 HG23 VAL A 76 -12.754 -12.190 2.559 1.00 41.35 H new ATOM 1163 N PRO A 77 -12.908 -15.269 1.940 1.00 61.35 N ATOM 1164 CA PRO A 77 -13.971 -15.917 2.684 1.00 74.55 C ATOM 1165 C PRO A 77 -14.516 -14.984 3.765 1.00 52.11 C ATOM 1166 O PRO A 77 -14.033 -13.862 3.961 1.00 74.45 O ATOM 1167 CB PRO A 77 -13.330 -17.170 3.280 1.00 30.30 C ATOM 1168 CG PRO A 77 -11.909 -16.707 3.552 1.00 43.11 C ATOM 1169 CD PRO A 77 -11.625 -15.815 2.349 1.00 33.53 C ATOM 0 HA PRO A 77 -14.825 -16.172 2.057 1.00 74.55 H new ATOM 0 HB2 PRO A 77 -13.835 -17.491 4.191 1.00 30.30 H new ATOM 0 HB3 PRO A 77 -13.358 -18.011 2.587 1.00 30.30 H new ATOM 0 HG2 PRO A 77 -11.832 -16.160 4.492 1.00 43.11 H new ATOM 0 HG3 PRO A 77 -11.213 -17.543 3.612 1.00 43.11 H new ATOM 0 HD2 PRO A 77 -10.928 -15.019 2.610 1.00 33.53 H new ATOM 0 HD3 PRO A 77 -11.169 -16.385 1.540 1.00 33.53 H new ATOM 1177 N SER A 78 -15.518 -15.472 4.495 1.00 24.52 N ATOM 1178 CA SER A 78 -16.368 -14.727 5.410 1.00 14.42 C ATOM 1179 C SER A 78 -15.607 -13.820 6.372 1.00 14.13 C ATOM 1180 O SER A 78 -16.131 -12.765 6.726 1.00 53.32 O ATOM 1181 CB SER A 78 -17.206 -15.724 6.202 1.00 21.52 C ATOM 1182 OG SER A 78 -17.820 -16.654 5.330 1.00 44.22 O ATOM 0 H SER A 78 -15.770 -16.460 4.458 1.00 24.52 H new ATOM 0 HA SER A 78 -16.987 -14.064 4.806 1.00 14.42 H new ATOM 0 HB2 SER A 78 -16.576 -16.250 6.919 1.00 21.52 H new ATOM 0 HB3 SER A 78 -17.968 -15.195 6.775 1.00 21.52 H new ATOM 0 HG SER A 78 -18.353 -17.289 5.852 1.00 44.22 H new ATOM 1188 N ASP A 79 -14.380 -14.194 6.744 1.00 31.23 N ATOM 1189 CA ASP A 79 -13.534 -13.466 7.680 1.00 13.41 C ATOM 1190 C ASP A 79 -13.353 -11.995 7.300 1.00 33.51 C ATOM 1191 O ASP A 79 -13.368 -11.148 8.188 1.00 62.33 O ATOM 1192 CB ASP A 79 -12.169 -14.143 7.784 1.00 4.22 C ATOM 1193 CG ASP A 79 -11.480 -13.745 9.080 1.00 72.21 C ATOM 1194 OD1 ASP A 79 -11.890 -14.323 10.118 1.00 63.35 O ATOM 1195 OD2 ASP A 79 -10.582 -12.875 9.053 1.00 31.40 O ATOM 0 H ASP A 79 -13.938 -15.041 6.387 1.00 31.23 H new ATOM 0 HA ASP A 79 -14.040 -13.488 8.645 1.00 13.41 H new ATOM 0 HB2 ASP A 79 -12.289 -15.226 7.745 1.00 4.22 H new ATOM 0 HB3 ASP A 79 -11.549 -13.860 6.933 1.00 4.22 H new ATOM 1200 N ASP A 80 -13.286 -11.674 6.000 1.00 2.00 N ATOM 1201 CA ASP A 80 -13.197 -10.290 5.503 1.00 3.35 C ATOM 1202 C ASP A 80 -14.132 -10.024 4.318 1.00 74.11 C ATOM 1203 O ASP A 80 -14.060 -8.971 3.672 1.00 24.15 O ATOM 1204 CB ASP A 80 -11.742 -9.904 5.156 1.00 12.35 C ATOM 1205 CG ASP A 80 -11.092 -9.024 6.218 1.00 71.31 C ATOM 1206 OD1 ASP A 80 -11.694 -7.983 6.559 1.00 64.50 O ATOM 1207 OD2 ASP A 80 -9.934 -9.273 6.608 1.00 21.31 O ATOM 0 H ASP A 80 -13.292 -12.372 5.256 1.00 2.00 H new ATOM 0 HA ASP A 80 -13.533 -9.652 6.320 1.00 3.35 H new ATOM 0 HB2 ASP A 80 -11.151 -10.811 5.031 1.00 12.35 H new ATOM 0 HB3 ASP A 80 -11.728 -9.381 4.200 1.00 12.35 H new ATOM 1212 N PHE A 81 -15.010 -10.979 3.986 1.00 32.15 N ATOM 1213 CA PHE A 81 -15.758 -10.963 2.739 1.00 13.31 C ATOM 1214 C PHE A 81 -16.545 -9.662 2.560 1.00 61.50 C ATOM 1215 O PHE A 81 -16.685 -9.187 1.431 1.00 21.11 O ATOM 1216 CB PHE A 81 -16.695 -12.179 2.654 1.00 25.24 C ATOM 1217 CG PHE A 81 -17.432 -12.328 1.337 1.00 31.31 C ATOM 1218 CD1 PHE A 81 -16.792 -12.005 0.124 1.00 65.12 C ATOM 1219 CD2 PHE A 81 -18.760 -12.799 1.312 1.00 70.51 C ATOM 1220 CE1 PHE A 81 -17.480 -12.090 -1.091 1.00 70.33 C ATOM 1221 CE2 PHE A 81 -19.448 -12.886 0.088 1.00 12.03 C ATOM 1222 CZ PHE A 81 -18.814 -12.524 -1.112 1.00 24.34 C ATOM 0 H PHE A 81 -15.216 -11.782 4.580 1.00 32.15 H new ATOM 0 HA PHE A 81 -15.035 -11.020 1.925 1.00 13.31 H new ATOM 0 HB2 PHE A 81 -16.111 -13.082 2.831 1.00 25.24 H new ATOM 0 HB3 PHE A 81 -17.428 -12.111 3.458 1.00 25.24 H new ATOM 0 HD1 PHE A 81 -15.759 -11.688 0.132 1.00 65.12 H new ATOM 0 HD2 PHE A 81 -19.248 -13.092 2.230 1.00 70.51 H new ATOM 0 HE1 PHE A 81 -16.985 -11.822 -2.012 1.00 70.33 H new ATOM 0 HE2 PHE A 81 -20.470 -13.233 0.071 1.00 12.03 H new ATOM 0 HZ PHE A 81 -19.351 -12.580 -2.047 1.00 24.34 H new ATOM 1232 N ASN A 82 -17.061 -9.073 3.639 1.00 65.30 N ATOM 1233 CA ASN A 82 -17.958 -7.938 3.636 1.00 10.35 C ATOM 1234 C ASN A 82 -17.324 -6.693 4.275 1.00 70.53 C ATOM 1235 O ASN A 82 -18.035 -5.745 4.608 1.00 72.14 O ATOM 1236 CB ASN A 82 -19.281 -8.359 4.288 1.00 50.42 C ATOM 1237 CG ASN A 82 -19.170 -8.911 5.705 1.00 34.31 C ATOM 1238 OD1 ASN A 82 -18.987 -8.166 6.663 1.00 51.11 O ATOM 1239 ND2 ASN A 82 -19.280 -10.223 5.865 1.00 3.14 N ATOM 0 H ASN A 82 -16.848 -9.398 4.582 1.00 65.30 H new ATOM 0 HA ASN A 82 -18.165 -7.635 2.610 1.00 10.35 H new ATOM 0 HB2 ASN A 82 -19.948 -7.497 4.304 1.00 50.42 H new ATOM 0 HB3 ASN A 82 -19.751 -9.114 3.659 1.00 50.42 H new ATOM 0 HD21 ASN A 82 -19.213 -10.630 6.798 1.00 3.14 H new ATOM 0 HD22 ASN A 82 -19.432 -10.825 5.055 1.00 3.14 H new ATOM 1246 N THR A 83 -16.000 -6.638 4.407 1.00 73.32 N ATOM 1247 CA THR A 83 -15.317 -5.554 5.106 1.00 64.14 C ATOM 1248 C THR A 83 -15.424 -4.183 4.409 1.00 1.35 C ATOM 1249 O THR A 83 -15.624 -4.080 3.190 1.00 14.45 O ATOM 1250 CB THR A 83 -13.898 -6.034 5.436 1.00 45.40 C ATOM 1251 OG1 THR A 83 -14.064 -7.178 6.237 1.00 31.23 O ATOM 1252 CG2 THR A 83 -13.103 -5.023 6.255 1.00 11.21 C ATOM 0 H THR A 83 -15.370 -7.346 4.031 1.00 73.32 H new ATOM 0 HA THR A 83 -15.826 -5.336 6.045 1.00 64.14 H new ATOM 0 HB THR A 83 -13.354 -6.203 4.507 1.00 45.40 H new ATOM 0 HG1 THR A 83 -13.232 -7.363 6.720 1.00 31.23 H new ATOM 0 HG21 THR A 83 -12.108 -5.420 6.457 1.00 11.21 H new ATOM 0 HG22 THR A 83 -13.016 -4.091 5.697 1.00 11.21 H new ATOM 0 HG23 THR A 83 -13.616 -4.835 7.198 1.00 11.21 H new ATOM 1260 N THR A 84 -15.320 -3.117 5.215 1.00 45.13 N ATOM 1261 CA THR A 84 -15.647 -1.728 4.903 1.00 25.23 C ATOM 1262 C THR A 84 -14.679 -0.785 5.631 1.00 11.41 C ATOM 1263 O THR A 84 -14.216 -1.135 6.711 1.00 24.34 O ATOM 1264 CB THR A 84 -17.106 -1.456 5.319 1.00 14.23 C ATOM 1265 OG1 THR A 84 -17.487 -2.125 6.517 1.00 32.42 O ATOM 1266 CG2 THR A 84 -18.089 -1.873 4.230 1.00 73.12 C ATOM 0 H THR A 84 -14.980 -3.216 6.171 1.00 45.13 H new ATOM 0 HA THR A 84 -15.544 -1.549 3.833 1.00 25.23 H new ATOM 0 HB THR A 84 -17.146 -0.380 5.486 1.00 14.23 H new ATOM 0 HG1 THR A 84 -18.420 -1.912 6.728 1.00 32.42 H new ATOM 0 HG21 THR A 84 -19.107 -1.666 4.560 1.00 73.12 H new ATOM 0 HG22 THR A 84 -17.882 -1.312 3.319 1.00 73.12 H new ATOM 0 HG23 THR A 84 -17.982 -2.939 4.032 1.00 73.12 H new ATOM 1274 N VAL A 85 -14.380 0.382 5.040 1.00 51.14 N ATOM 1275 CA VAL A 85 -13.464 1.392 5.596 1.00 12.34 C ATOM 1276 C VAL A 85 -13.856 2.812 5.163 1.00 2.01 C ATOM 1277 O VAL A 85 -14.289 3.035 4.031 1.00 5.32 O ATOM 1278 CB VAL A 85 -11.999 1.123 5.163 1.00 70.24 C ATOM 1279 CG1 VAL A 85 -11.259 0.326 6.231 1.00 63.20 C ATOM 1280 CG2 VAL A 85 -11.847 0.391 3.815 1.00 31.53 C ATOM 0 H VAL A 85 -14.777 0.657 4.142 1.00 51.14 H new ATOM 0 HA VAL A 85 -13.542 1.316 6.681 1.00 12.34 H new ATOM 0 HB VAL A 85 -11.565 2.115 5.036 1.00 70.24 H new ATOM 0 HG11 VAL A 85 -10.233 0.148 5.907 1.00 63.20 H new ATOM 0 HG12 VAL A 85 -11.252 0.888 7.165 1.00 63.20 H new ATOM 0 HG13 VAL A 85 -11.761 -0.629 6.386 1.00 63.20 H new ATOM 0 HG21 VAL A 85 -10.789 0.247 3.596 1.00 31.53 H new ATOM 0 HG22 VAL A 85 -12.341 -0.579 3.870 1.00 31.53 H new ATOM 0 HG23 VAL A 85 -12.304 0.986 3.024 1.00 31.53 H new ATOM 1290 N SER A 86 -13.673 3.821 6.019 1.00 30.41 N ATOM 1291 CA SER A 86 -13.727 5.216 5.587 1.00 62.53 C ATOM 1292 C SER A 86 -12.543 5.531 4.664 1.00 62.21 C ATOM 1293 O SER A 86 -11.464 4.955 4.814 1.00 22.54 O ATOM 1294 CB SER A 86 -13.802 6.156 6.792 1.00 54.23 C ATOM 1295 OG SER A 86 -15.147 6.570 6.941 1.00 23.13 O ATOM 0 H SER A 86 -13.486 3.696 7.014 1.00 30.41 H new ATOM 0 HA SER A 86 -14.638 5.378 5.010 1.00 62.53 H new ATOM 0 HB2 SER A 86 -13.457 5.649 7.693 1.00 54.23 H new ATOM 0 HB3 SER A 86 -13.152 7.018 6.644 1.00 54.23 H new ATOM 0 HG SER A 86 -15.443 7.022 6.123 1.00 23.13 H new ATOM 1301 N GLY A 87 -12.740 6.418 3.686 1.00 25.52 N ATOM 1302 CA GLY A 87 -11.718 6.811 2.719 1.00 42.14 C ATOM 1303 C GLY A 87 -10.511 7.400 3.441 1.00 52.41 C ATOM 1304 O GLY A 87 -9.370 7.034 3.165 1.00 22.31 O ATOM 0 H GLY A 87 -13.632 6.891 3.543 1.00 25.52 H new ATOM 0 HA2 GLY A 87 -11.413 5.946 2.130 1.00 42.14 H new ATOM 0 HA3 GLY A 87 -12.128 7.543 2.023 1.00 42.14 H new ATOM 1308 N GLU A 88 -10.794 8.279 4.403 1.00 33.52 N ATOM 1309 CA GLU A 88 -9.839 8.929 5.293 1.00 63.23 C ATOM 1310 C GLU A 88 -9.061 7.900 6.095 1.00 34.14 C ATOM 1311 O GLU A 88 -7.838 7.966 6.188 1.00 1.34 O ATOM 1312 CB GLU A 88 -10.647 9.797 6.257 1.00 12.24 C ATOM 1313 CG GLU A 88 -9.867 10.558 7.335 1.00 10.22 C ATOM 1314 CD GLU A 88 -10.766 10.894 8.534 1.00 50.10 C ATOM 1315 OE1 GLU A 88 -11.985 11.134 8.350 1.00 72.41 O ATOM 1316 OE2 GLU A 88 -10.261 10.902 9.677 1.00 10.22 O ATOM 0 H GLU A 88 -11.753 8.572 4.590 1.00 33.52 H new ATOM 0 HA GLU A 88 -9.128 9.517 4.712 1.00 63.23 H new ATOM 0 HB2 GLU A 88 -11.207 10.524 5.669 1.00 12.24 H new ATOM 0 HB3 GLU A 88 -11.377 9.159 6.755 1.00 12.24 H new ATOM 0 HG2 GLU A 88 -9.021 9.957 7.668 1.00 10.22 H new ATOM 0 HG3 GLU A 88 -9.460 11.477 6.913 1.00 10.22 H new ATOM 1323 N ASP A 89 -9.795 6.971 6.706 1.00 25.54 N ATOM 1324 CA ASP A 89 -9.242 5.994 7.637 1.00 70.50 C ATOM 1325 C ASP A 89 -8.246 5.084 6.918 1.00 12.12 C ATOM 1326 O ASP A 89 -7.228 4.657 7.458 1.00 44.01 O ATOM 1327 CB ASP A 89 -10.400 5.136 8.159 1.00 12.02 C ATOM 1328 CG ASP A 89 -9.951 4.046 9.129 1.00 31.35 C ATOM 1329 OD1 ASP A 89 -9.694 4.380 10.306 1.00 70.54 O ATOM 1330 OD2 ASP A 89 -9.939 2.858 8.729 1.00 50.23 O ATOM 0 H ASP A 89 -10.801 6.876 6.566 1.00 25.54 H new ATOM 0 HA ASP A 89 -8.730 6.508 8.451 1.00 70.50 H new ATOM 0 HB2 ASP A 89 -11.125 5.780 8.657 1.00 12.02 H new ATOM 0 HB3 ASP A 89 -10.911 4.674 7.314 1.00 12.02 H new ATOM 1335 N SER A 90 -8.550 4.826 5.650 1.00 12.35 N ATOM 1336 CA SER A 90 -7.730 4.081 4.711 1.00 44.41 C ATOM 1337 C SER A 90 -6.457 4.857 4.297 1.00 25.42 C ATOM 1338 O SER A 90 -5.573 4.281 3.663 1.00 24.53 O ATOM 1339 CB SER A 90 -8.671 3.683 3.562 1.00 22.33 C ATOM 1340 OG SER A 90 -8.073 3.022 2.466 1.00 30.21 O ATOM 0 H SER A 90 -9.422 5.150 5.231 1.00 12.35 H new ATOM 0 HA SER A 90 -7.307 3.178 5.151 1.00 44.41 H new ATOM 0 HB2 SER A 90 -9.452 3.039 3.966 1.00 22.33 H new ATOM 0 HB3 SER A 90 -9.161 4.584 3.193 1.00 22.33 H new ATOM 0 HG SER A 90 -7.113 3.217 2.451 1.00 30.21 H new ATOM 1346 N TRP A 91 -6.301 6.134 4.665 1.00 21.13 N ATOM 1347 CA TRP A 91 -5.111 6.943 4.387 1.00 53.41 C ATOM 1348 C TRP A 91 -4.315 7.242 5.655 1.00 3.05 C ATOM 1349 O TRP A 91 -3.082 7.288 5.616 1.00 73.41 O ATOM 1350 CB TRP A 91 -5.549 8.229 3.671 1.00 54.24 C ATOM 1351 CG TRP A 91 -4.481 9.234 3.366 1.00 71.42 C ATOM 1352 CD1 TRP A 91 -3.892 9.431 2.164 1.00 35.24 C ATOM 1353 CD2 TRP A 91 -3.890 10.221 4.263 1.00 1.34 C ATOM 1354 NE1 TRP A 91 -2.963 10.443 2.258 1.00 23.21 N ATOM 1355 CE2 TRP A 91 -2.906 10.957 3.539 1.00 51.01 C ATOM 1356 CE3 TRP A 91 -4.090 10.566 5.619 1.00 1.02 C ATOM 1357 CZ2 TRP A 91 -2.135 11.957 4.148 1.00 51.44 C ATOM 1358 CZ3 TRP A 91 -3.342 11.592 6.226 1.00 33.15 C ATOM 1359 CH2 TRP A 91 -2.364 12.283 5.494 1.00 42.34 C ATOM 0 H TRP A 91 -7.019 6.646 5.178 1.00 21.13 H new ATOM 0 HA TRP A 91 -4.438 6.381 3.740 1.00 53.41 H new ATOM 0 HB2 TRP A 91 -6.028 7.948 2.733 1.00 54.24 H new ATOM 0 HB3 TRP A 91 -6.308 8.716 4.283 1.00 54.24 H new ATOM 0 HD1 TRP A 91 -4.117 8.877 1.265 1.00 35.24 H new ATOM 0 HE1 TRP A 91 -2.390 10.771 1.481 1.00 23.21 H new ATOM 0 HE3 TRP A 91 -4.829 10.033 6.199 1.00 1.02 H new ATOM 0 HZ2 TRP A 91 -1.371 12.473 3.586 1.00 51.44 H new ATOM 0 HZ3 TRP A 91 -3.521 11.849 7.260 1.00 33.15 H new ATOM 0 HH2 TRP A 91 -1.788 13.065 5.966 1.00 42.34 H new ATOM 1370 N LYS A 92 -5.013 7.425 6.778 1.00 52.03 N ATOM 1371 CA LYS A 92 -4.475 7.777 8.079 1.00 50.41 C ATOM 1372 C LYS A 92 -3.359 6.826 8.475 1.00 70.10 C ATOM 1373 O LYS A 92 -2.198 7.175 8.274 1.00 30.51 O ATOM 1374 CB LYS A 92 -5.638 7.788 9.086 1.00 50.02 C ATOM 1375 CG LYS A 92 -6.440 9.085 8.959 1.00 34.14 C ATOM 1376 CD LYS A 92 -5.723 10.218 9.663 1.00 3.33 C ATOM 1377 CE LYS A 92 -6.154 11.544 9.065 1.00 70.22 C ATOM 1378 NZ LYS A 92 -5.674 12.670 9.883 1.00 64.10 N ATOM 0 H LYS A 92 -6.028 7.324 6.797 1.00 52.03 H new ATOM 0 HA LYS A 92 -4.024 8.769 8.057 1.00 50.41 H new ATOM 0 HB2 LYS A 92 -6.289 6.932 8.909 1.00 50.02 H new ATOM 0 HB3 LYS A 92 -5.251 7.690 10.100 1.00 50.02 H new ATOM 0 HG2 LYS A 92 -6.580 9.332 7.907 1.00 34.14 H new ATOM 0 HG3 LYS A 92 -7.432 8.950 9.389 1.00 34.14 H new ATOM 0 HD2 LYS A 92 -5.949 10.198 10.729 1.00 3.33 H new ATOM 0 HD3 LYS A 92 -4.644 10.096 9.564 1.00 3.33 H new ATOM 0 HE2 LYS A 92 -5.764 11.634 8.051 1.00 70.22 H new ATOM 0 HE3 LYS A 92 -7.241 11.579 8.993 1.00 70.22 H new ATOM 0 HZ1 LYS A 92 -6.355 13.454 9.828 1.00 64.10 H new ATOM 0 HZ2 LYS A 92 -5.577 12.364 10.872 1.00 64.10 H new ATOM 0 HZ3 LYS A 92 -4.750 12.988 9.527 1.00 64.10 H new ATOM 1392 N THR A 93 -3.705 5.652 8.992 1.00 71.22 N ATOM 1393 CA THR A 93 -2.792 4.700 9.609 1.00 22.43 C ATOM 1394 C THR A 93 -1.639 4.359 8.659 1.00 10.32 C ATOM 1395 O THR A 93 -0.492 4.244 9.088 1.00 73.34 O ATOM 1396 CB THR A 93 -3.604 3.448 9.992 1.00 53.23 C ATOM 1397 OG1 THR A 93 -4.950 3.796 10.286 1.00 1.45 O ATOM 1398 CG2 THR A 93 -3.037 2.663 11.171 1.00 33.44 C ATOM 0 H THR A 93 -4.671 5.325 8.992 1.00 71.22 H new ATOM 0 HA THR A 93 -2.340 5.129 10.503 1.00 22.43 H new ATOM 0 HB THR A 93 -3.546 2.799 9.118 1.00 53.23 H new ATOM 0 HG1 THR A 93 -5.546 3.078 9.987 1.00 1.45 H new ATOM 0 HG21 THR A 93 -3.671 1.799 11.371 1.00 33.44 H new ATOM 0 HG22 THR A 93 -2.028 2.326 10.932 1.00 33.44 H new ATOM 0 HG23 THR A 93 -3.006 3.303 12.053 1.00 33.44 H new ATOM 1406 N LEU A 94 -1.929 4.253 7.356 1.00 73.14 N ATOM 1407 CA LEU A 94 -0.957 4.027 6.292 1.00 65.34 C ATOM 1408 C LEU A 94 0.165 5.055 6.393 1.00 3.15 C ATOM 1409 O LEU A 94 1.329 4.686 6.564 1.00 50.40 O ATOM 1410 CB LEU A 94 -1.703 4.055 4.941 1.00 52.11 C ATOM 1411 CG LEU A 94 -0.875 3.815 3.659 1.00 23.53 C ATOM 1412 CD1 LEU A 94 -1.848 3.604 2.492 1.00 54.11 C ATOM 1413 CD2 LEU A 94 0.029 4.988 3.257 1.00 30.22 C ATOM 0 H LEU A 94 -2.884 4.326 7.006 1.00 73.14 H new ATOM 0 HA LEU A 94 -0.480 3.051 6.384 1.00 65.34 H new ATOM 0 HB2 LEU A 94 -2.491 3.303 4.977 1.00 52.11 H new ATOM 0 HB3 LEU A 94 -2.192 5.025 4.848 1.00 52.11 H new ATOM 0 HG LEU A 94 -0.237 2.957 3.871 1.00 23.53 H new ATOM 0 HD11 LEU A 94 -1.284 3.432 1.575 1.00 54.11 H new ATOM 0 HD12 LEU A 94 -2.480 2.740 2.697 1.00 54.11 H new ATOM 0 HD13 LEU A 94 -2.472 4.490 2.374 1.00 54.11 H new ATOM 0 HD21 LEU A 94 0.573 4.733 2.347 1.00 30.22 H new ATOM 0 HD22 LEU A 94 -0.581 5.873 3.079 1.00 30.22 H new ATOM 0 HD23 LEU A 94 0.739 5.192 4.059 1.00 30.22 H new ATOM 1425 N THR A 95 -0.156 6.346 6.296 1.00 13.15 N ATOM 1426 CA THR A 95 0.873 7.374 6.339 1.00 64.33 C ATOM 1427 C THR A 95 1.589 7.374 7.695 1.00 43.42 C ATOM 1428 O THR A 95 2.818 7.507 7.718 1.00 72.20 O ATOM 1429 CB THR A 95 0.317 8.750 5.935 1.00 71.54 C ATOM 1430 OG1 THR A 95 -0.795 9.145 6.714 1.00 45.20 O ATOM 1431 CG2 THR A 95 -0.072 8.791 4.453 1.00 21.23 C ATOM 0 H THR A 95 -1.108 6.697 6.189 1.00 13.15 H new ATOM 0 HA THR A 95 1.631 7.137 5.593 1.00 64.33 H new ATOM 0 HB THR A 95 1.129 9.454 6.118 1.00 71.54 H new ATOM 0 HG1 THR A 95 -1.082 8.397 7.278 1.00 45.20 H new ATOM 0 HG21 THR A 95 -0.460 9.779 4.206 1.00 21.23 H new ATOM 0 HG22 THR A 95 0.805 8.582 3.841 1.00 21.23 H new ATOM 0 HG23 THR A 95 -0.838 8.041 4.257 1.00 21.23 H new ATOM 1439 N SER A 96 0.871 7.134 8.802 1.00 53.31 N ATOM 1440 CA SER A 96 1.418 7.060 10.141 1.00 2.44 C ATOM 1441 C SER A 96 2.385 5.898 10.359 1.00 70.10 C ATOM 1442 O SER A 96 3.088 5.876 11.369 1.00 61.10 O ATOM 1443 CB SER A 96 0.278 6.984 11.157 1.00 71.51 C ATOM 1444 OG SER A 96 -0.922 7.567 10.691 1.00 25.42 O ATOM 0 H SER A 96 -0.137 6.983 8.776 1.00 53.31 H new ATOM 0 HA SER A 96 2.004 7.968 10.281 1.00 2.44 H new ATOM 0 HB2 SER A 96 0.093 5.940 11.409 1.00 71.51 H new ATOM 0 HB3 SER A 96 0.585 7.484 12.076 1.00 71.51 H new ATOM 0 HG SER A 96 -1.614 7.487 11.381 1.00 25.42 H new ATOM 1450 N LYS A 97 2.472 4.954 9.421 1.00 33.21 N ATOM 1451 CA LYS A 97 3.204 3.704 9.567 1.00 32.23 C ATOM 1452 C LYS A 97 4.299 3.540 8.506 1.00 13.43 C ATOM 1453 O LYS A 97 5.012 2.537 8.527 1.00 25.41 O ATOM 1454 CB LYS A 97 2.140 2.592 9.561 1.00 25.15 C ATOM 1455 CG LYS A 97 2.610 1.207 10.030 1.00 61.31 C ATOM 1456 CD LYS A 97 3.060 1.075 11.492 1.00 23.43 C ATOM 1457 CE LYS A 97 4.023 -0.107 11.666 1.00 72.42 C ATOM 1458 NZ LYS A 97 3.388 -1.438 11.507 1.00 23.14 N ATOM 0 H LYS A 97 2.019 5.045 8.512 1.00 33.21 H new ATOM 0 HA LYS A 97 3.767 3.670 10.500 1.00 32.23 H new ATOM 0 HB2 LYS A 97 1.311 2.906 10.195 1.00 25.15 H new ATOM 0 HB3 LYS A 97 1.748 2.497 8.548 1.00 25.15 H new ATOM 0 HG2 LYS A 97 1.798 0.500 9.862 1.00 61.31 H new ATOM 0 HG3 LYS A 97 3.438 0.898 9.393 1.00 61.31 H new ATOM 0 HD2 LYS A 97 3.548 1.996 11.811 1.00 23.43 H new ATOM 0 HD3 LYS A 97 2.189 0.937 12.133 1.00 23.43 H new ATOM 0 HE2 LYS A 97 4.830 -0.013 10.940 1.00 72.42 H new ATOM 0 HE3 LYS A 97 4.476 -0.049 12.656 1.00 72.42 H new ATOM 0 HZ1 LYS A 97 3.957 -2.155 12.001 1.00 23.14 H new ATOM 0 HZ2 LYS A 97 2.430 -1.416 11.912 1.00 23.14 H new ATOM 0 HZ3 LYS A 97 3.331 -1.677 10.496 1.00 23.14 H new ATOM 1472 N LEU A 98 4.488 4.508 7.598 1.00 52.32 N ATOM 1473 CA LEU A 98 5.580 4.472 6.611 1.00 12.44 C ATOM 1474 C LEU A 98 6.787 5.302 7.050 1.00 5.12 C ATOM 1475 O LEU A 98 7.929 4.920 6.775 1.00 53.41 O ATOM 1476 CB LEU A 98 5.099 4.962 5.238 1.00 50.34 C ATOM 1477 CG LEU A 98 4.139 4.007 4.502 1.00 23.11 C ATOM 1478 CD1 LEU A 98 3.626 4.706 3.240 1.00 63.52 C ATOM 1479 CD2 LEU A 98 4.805 2.686 4.096 1.00 43.02 C ATOM 0 H LEU A 98 3.893 5.333 7.526 1.00 52.32 H new ATOM 0 HA LEU A 98 5.892 3.430 6.537 1.00 12.44 H new ATOM 0 HB2 LEU A 98 4.602 5.924 5.366 1.00 50.34 H new ATOM 0 HB3 LEU A 98 5.970 5.135 4.606 1.00 50.34 H new ATOM 0 HG LEU A 98 3.328 3.765 5.189 1.00 23.11 H new ATOM 0 HD11 LEU A 98 2.945 4.042 2.708 1.00 63.52 H new ATOM 0 HD12 LEU A 98 3.100 5.619 3.518 1.00 63.52 H new ATOM 0 HD13 LEU A 98 4.468 4.955 2.594 1.00 63.52 H new ATOM 0 HD21 LEU A 98 4.079 2.056 3.582 1.00 43.02 H new ATOM 0 HD22 LEU A 98 5.644 2.891 3.431 1.00 43.02 H new ATOM 0 HD23 LEU A 98 5.166 2.172 4.987 1.00 43.02 H new ATOM 1491 N LYS A 99 6.577 6.431 7.740 1.00 21.32 N ATOM 1492 CA LYS A 99 7.678 7.279 8.223 1.00 42.30 C ATOM 1493 C LYS A 99 8.553 6.496 9.218 1.00 23.34 C ATOM 1494 O LYS A 99 9.743 6.770 9.352 1.00 11.14 O ATOM 1495 CB LYS A 99 7.070 8.544 8.853 1.00 50.32 C ATOM 1496 CG LYS A 99 8.018 9.639 9.355 1.00 43.42 C ATOM 1497 CD LYS A 99 8.679 10.465 8.248 1.00 53.11 C ATOM 1498 CE LYS A 99 9.204 11.758 8.886 1.00 53.41 C ATOM 1499 NZ LYS A 99 9.543 12.782 7.882 1.00 54.31 N ATOM 0 H LYS A 99 5.649 6.781 7.978 1.00 21.32 H new ATOM 0 HA LYS A 99 8.328 7.576 7.400 1.00 42.30 H new ATOM 0 HB2 LYS A 99 6.404 8.994 8.117 1.00 50.32 H new ATOM 0 HB3 LYS A 99 6.451 8.231 9.693 1.00 50.32 H new ATOM 0 HG2 LYS A 99 7.462 10.311 10.009 1.00 43.42 H new ATOM 0 HG3 LYS A 99 8.798 9.177 9.961 1.00 43.42 H new ATOM 0 HD2 LYS A 99 9.494 9.906 7.788 1.00 53.11 H new ATOM 0 HD3 LYS A 99 7.962 10.691 7.459 1.00 53.11 H new ATOM 0 HE2 LYS A 99 8.451 12.156 9.567 1.00 53.41 H new ATOM 0 HE3 LYS A 99 10.087 11.533 9.484 1.00 53.41 H new ATOM 0 HZ1 LYS A 99 10.527 13.089 8.018 1.00 54.31 H new ATOM 0 HZ2 LYS A 99 9.434 12.382 6.928 1.00 54.31 H new ATOM 0 HZ3 LYS A 99 8.908 13.598 7.990 1.00 54.31 H new ATOM 1513 N GLU A 100 7.977 5.461 9.831 1.00 3.04 N ATOM 1514 CA GLU A 100 8.581 4.455 10.692 1.00 42.42 C ATOM 1515 C GLU A 100 9.898 3.930 10.132 1.00 2.21 C ATOM 1516 O GLU A 100 10.898 3.867 10.844 1.00 71.34 O ATOM 1517 CB GLU A 100 7.607 3.289 10.829 1.00 52.23 C ATOM 1518 CG GLU A 100 6.713 3.458 12.052 1.00 24.45 C ATOM 1519 CD GLU A 100 7.088 2.460 13.142 1.00 71.50 C ATOM 1520 OE1 GLU A 100 8.217 2.591 13.671 1.00 44.00 O ATOM 1521 OE2 GLU A 100 6.302 1.524 13.404 1.00 53.11 O ATOM 0 H GLU A 100 6.977 5.294 9.723 1.00 3.04 H new ATOM 0 HA GLU A 100 8.791 4.918 11.656 1.00 42.42 H new ATOM 0 HB2 GLU A 100 6.991 3.219 9.932 1.00 52.23 H new ATOM 0 HB3 GLU A 100 8.163 2.355 10.908 1.00 52.23 H new ATOM 0 HG2 GLU A 100 6.804 4.474 12.436 1.00 24.45 H new ATOM 0 HG3 GLU A 100 5.670 3.317 11.767 1.00 24.45 H new ATOM 1528 N LYS A 101 9.894 3.539 8.854 1.00 2.35 N ATOM 1529 CA LYS A 101 11.043 2.950 8.168 1.00 64.22 C ATOM 1530 C LYS A 101 11.656 3.946 7.180 1.00 70.24 C ATOM 1531 O LYS A 101 12.463 3.551 6.334 1.00 34.22 O ATOM 1532 CB LYS A 101 10.638 1.608 7.524 1.00 51.40 C ATOM 1533 CG LYS A 101 10.349 0.519 8.572 1.00 1.11 C ATOM 1534 CD LYS A 101 8.857 0.315 8.876 1.00 34.41 C ATOM 1535 CE LYS A 101 8.618 -0.342 10.242 1.00 25.52 C ATOM 1536 NZ LYS A 101 9.201 -1.696 10.338 1.00 53.22 N ATOM 0 H LYS A 101 9.072 3.626 8.256 1.00 2.35 H new ATOM 0 HA LYS A 101 11.830 2.727 8.889 1.00 64.22 H new ATOM 0 HB2 LYS A 101 9.753 1.757 6.905 1.00 51.40 H new ATOM 0 HB3 LYS A 101 11.436 1.270 6.863 1.00 51.40 H new ATOM 0 HG2 LYS A 101 10.769 -0.425 8.224 1.00 1.11 H new ATOM 0 HG3 LYS A 101 10.865 0.776 9.497 1.00 1.11 H new ATOM 0 HD2 LYS A 101 8.349 1.279 8.847 1.00 34.41 H new ATOM 0 HD3 LYS A 101 8.412 -0.304 8.097 1.00 34.41 H new ATOM 0 HE2 LYS A 101 9.045 0.288 11.022 1.00 25.52 H new ATOM 0 HE3 LYS A 101 7.546 -0.399 10.429 1.00 25.52 H new ATOM 0 HZ1 LYS A 101 9.009 -2.091 11.281 1.00 53.22 H new ATOM 0 HZ2 LYS A 101 8.776 -2.309 9.613 1.00 53.22 H new ATOM 0 HZ3 LYS A 101 10.229 -1.643 10.188 1.00 53.22 H new ATOM 1550 N GLY A 102 11.279 5.226 7.272 1.00 52.04 N ATOM 1551 CA GLY A 102 11.710 6.277 6.367 1.00 23.53 C ATOM 1552 C GLY A 102 11.311 5.945 4.935 1.00 61.14 C ATOM 1553 O GLY A 102 12.127 6.094 4.027 1.00 63.33 O ATOM 0 H GLY A 102 10.648 5.560 8.001 1.00 52.04 H new ATOM 0 HA2 GLY A 102 11.264 7.226 6.664 1.00 23.53 H new ATOM 0 HA3 GLY A 102 12.791 6.399 6.430 1.00 23.53 H new ATOM 1557 N LEU A 103 10.078 5.454 4.749 1.00 14.03 N ATOM 1558 CA LEU A 103 9.507 5.056 3.461 1.00 1.43 C ATOM 1559 C LEU A 103 8.518 6.111 2.940 1.00 74.41 C ATOM 1560 O LEU A 103 7.722 5.811 2.048 1.00 10.12 O ATOM 1561 CB LEU A 103 8.854 3.662 3.567 1.00 31.33 C ATOM 1562 CG LEU A 103 9.827 2.519 3.910 1.00 33.21 C ATOM 1563 CD1 LEU A 103 9.048 1.216 4.102 1.00 41.33 C ATOM 1564 CD2 LEU A 103 10.895 2.286 2.833 1.00 34.23 C ATOM 0 H LEU A 103 9.428 5.319 5.524 1.00 14.03 H new ATOM 0 HA LEU A 103 10.315 4.991 2.733 1.00 1.43 H new ATOM 0 HB2 LEU A 103 8.075 3.698 4.328 1.00 31.33 H new ATOM 0 HB3 LEU A 103 8.365 3.432 2.621 1.00 31.33 H new ATOM 0 HG LEU A 103 10.337 2.818 4.826 1.00 33.21 H new ATOM 0 HD11 LEU A 103 9.741 0.410 4.345 1.00 41.33 H new ATOM 0 HD12 LEU A 103 8.332 1.336 4.915 1.00 41.33 H new ATOM 0 HD13 LEU A 103 8.515 0.972 3.183 1.00 41.33 H new ATOM 0 HD21 LEU A 103 11.547 1.467 3.138 1.00 34.23 H new ATOM 0 HD22 LEU A 103 10.411 2.032 1.890 1.00 34.23 H new ATOM 0 HD23 LEU A 103 11.487 3.193 2.705 1.00 34.23 H new ATOM 1576 N VAL A 104 8.558 7.320 3.500 1.00 12.14 N ATOM 1577 CA VAL A 104 7.963 8.546 2.984 1.00 51.44 C ATOM 1578 C VAL A 104 8.903 9.694 3.359 1.00 21.53 C ATOM 1579 O VAL A 104 9.716 9.553 4.285 1.00 44.01 O ATOM 1580 CB VAL A 104 6.551 8.812 3.559 1.00 73.44 C ATOM 1581 CG1 VAL A 104 5.492 7.882 2.964 1.00 4.24 C ATOM 1582 CG2 VAL A 104 6.489 8.700 5.090 1.00 30.55 C ATOM 0 H VAL A 104 9.040 7.476 4.385 1.00 12.14 H new ATOM 0 HA VAL A 104 7.840 8.456 1.905 1.00 51.44 H new ATOM 0 HB VAL A 104 6.334 9.841 3.274 1.00 73.44 H new ATOM 0 HG11 VAL A 104 4.520 8.111 3.401 1.00 4.24 H new ATOM 0 HG12 VAL A 104 5.447 8.025 1.884 1.00 4.24 H new ATOM 0 HG13 VAL A 104 5.753 6.846 3.182 1.00 4.24 H new ATOM 0 HG21 VAL A 104 5.472 8.898 5.428 1.00 30.55 H new ATOM 0 HG22 VAL A 104 6.783 7.695 5.394 1.00 30.55 H new ATOM 0 HG23 VAL A 104 7.168 9.427 5.536 1.00 30.55 H new ATOM 1592 N THR A 105 8.741 10.845 2.715 1.00 72.54 N ATOM 1593 CA THR A 105 9.304 12.105 3.172 1.00 61.30 C ATOM 1594 C THR A 105 8.176 12.916 3.810 1.00 31.23 C ATOM 1595 O THR A 105 7.002 12.667 3.532 1.00 34.13 O ATOM 1596 CB THR A 105 9.974 12.848 1.997 1.00 2.43 C ATOM 1597 OG1 THR A 105 9.019 13.411 1.118 1.00 15.21 O ATOM 1598 CG2 THR A 105 10.887 11.940 1.161 1.00 2.15 C ATOM 0 H THR A 105 8.207 10.927 1.850 1.00 72.54 H new ATOM 0 HA THR A 105 10.084 11.941 3.915 1.00 61.30 H new ATOM 0 HB THR A 105 10.570 13.631 2.466 1.00 2.43 H new ATOM 0 HG1 THR A 105 8.656 14.232 1.512 1.00 15.21 H new ATOM 0 HG21 THR A 105 11.330 12.517 0.350 1.00 2.15 H new ATOM 0 HG22 THR A 105 11.678 11.537 1.794 1.00 2.15 H new ATOM 0 HG23 THR A 105 10.302 11.120 0.745 1.00 2.15 H new ATOM 1606 N ASP A 106 8.509 13.953 4.585 1.00 14.21 N ATOM 1607 CA ASP A 106 7.534 15.017 4.838 1.00 4.22 C ATOM 1608 C ASP A 106 7.171 15.622 3.485 1.00 4.41 C ATOM 1609 O ASP A 106 8.036 15.715 2.606 1.00 63.11 O ATOM 1610 CB ASP A 106 8.128 16.112 5.752 1.00 1.22 C ATOM 1611 CG ASP A 106 7.515 16.133 7.147 1.00 55.02 C ATOM 1612 OD1 ASP A 106 7.871 15.266 7.975 1.00 41.12 O ATOM 1613 OD2 ASP A 106 6.686 17.019 7.448 1.00 4.05 O ATOM 0 H ASP A 106 9.416 14.077 5.035 1.00 14.21 H new ATOM 0 HA ASP A 106 6.658 14.608 5.342 1.00 4.22 H new ATOM 0 HB2 ASP A 106 9.204 15.959 5.838 1.00 1.22 H new ATOM 0 HB3 ASP A 106 7.981 17.085 5.284 1.00 1.22 H new ATOM 1618 N GLY A 107 5.923 16.056 3.319 1.00 14.04 N ATOM 1619 CA GLY A 107 5.508 16.840 2.164 1.00 20.24 C ATOM 1620 C GLY A 107 5.468 16.066 0.845 1.00 15.25 C ATOM 1621 O GLY A 107 5.340 16.691 -0.208 1.00 42.20 O ATOM 0 H GLY A 107 5.172 15.872 3.984 1.00 14.04 H new ATOM 0 HA2 GLY A 107 4.517 17.251 2.358 1.00 20.24 H new ATOM 0 HA3 GLY A 107 6.187 17.685 2.053 1.00 20.24 H new ATOM 1625 N GLN A 108 5.578 14.734 0.870 1.00 34.41 N ATOM 1626 CA GLN A 108 4.994 13.911 -0.185 1.00 33.15 C ATOM 1627 C GLN A 108 3.474 14.012 -0.071 1.00 51.13 C ATOM 1628 O GLN A 108 2.949 14.472 0.946 1.00 24.43 O ATOM 1629 CB GLN A 108 5.477 12.459 -0.056 1.00 63.42 C ATOM 1630 CG GLN A 108 6.702 12.222 -0.954 1.00 12.55 C ATOM 1631 CD GLN A 108 7.453 10.936 -0.615 1.00 14.22 C ATOM 1632 OE1 GLN A 108 7.137 10.220 0.329 1.00 44.13 O ATOM 1633 NE2 GLN A 108 8.484 10.609 -1.373 1.00 22.12 N ATOM 0 H GLN A 108 6.060 14.211 1.601 1.00 34.41 H new ATOM 0 HA GLN A 108 5.307 14.263 -1.168 1.00 33.15 H new ATOM 0 HB2 GLN A 108 5.732 12.244 0.982 1.00 63.42 H new ATOM 0 HB3 GLN A 108 4.675 11.776 -0.336 1.00 63.42 H new ATOM 0 HG2 GLN A 108 6.380 12.184 -1.995 1.00 12.55 H new ATOM 0 HG3 GLN A 108 7.382 13.068 -0.861 1.00 12.55 H new ATOM 0 HE21 GLN A 108 8.748 11.203 -2.159 1.00 22.12 H new ATOM 0 HE22 GLN A 108 9.016 9.762 -1.173 1.00 22.12 H new ATOM 1642 N THR A 109 2.766 13.533 -1.090 1.00 22.43 N ATOM 1643 CA THR A 109 1.312 13.521 -1.129 1.00 60.41 C ATOM 1644 C THR A 109 0.922 12.118 -1.596 1.00 54.00 C ATOM 1645 O THR A 109 1.425 11.671 -2.630 1.00 15.21 O ATOM 1646 CB THR A 109 0.779 14.652 -2.044 1.00 21.53 C ATOM 1647 OG1 THR A 109 1.726 15.693 -2.260 1.00 60.00 O ATOM 1648 CG2 THR A 109 -0.455 15.319 -1.435 1.00 73.22 C ATOM 0 H THR A 109 3.197 13.136 -1.925 1.00 22.43 H new ATOM 0 HA THR A 109 0.864 13.722 -0.156 1.00 60.41 H new ATOM 0 HB THR A 109 0.551 14.158 -2.989 1.00 21.53 H new ATOM 0 HG1 THR A 109 1.335 16.375 -2.845 1.00 60.00 H new ATOM 0 HG21 THR A 109 -0.807 16.109 -2.099 1.00 73.22 H new ATOM 0 HG22 THR A 109 -1.243 14.577 -1.304 1.00 73.22 H new ATOM 0 HG23 THR A 109 -0.196 15.748 -0.467 1.00 73.22 H new ATOM 1656 N VAL A 110 0.118 11.387 -0.822 1.00 51.21 N ATOM 1657 CA VAL A 110 -0.236 9.993 -1.107 1.00 15.24 C ATOM 1658 C VAL A 110 -1.695 9.942 -1.571 1.00 13.13 C ATOM 1659 O VAL A 110 -2.579 10.324 -0.799 1.00 63.54 O ATOM 1660 CB VAL A 110 0.033 9.110 0.133 1.00 20.15 C ATOM 1661 CG1 VAL A 110 -0.238 7.626 -0.165 1.00 14.24 C ATOM 1662 CG2 VAL A 110 1.482 9.261 0.632 1.00 61.30 C ATOM 0 H VAL A 110 -0.311 11.749 0.030 1.00 51.21 H new ATOM 0 HA VAL A 110 0.385 9.593 -1.909 1.00 15.24 H new ATOM 0 HB VAL A 110 -0.650 9.452 0.910 1.00 20.15 H new ATOM 0 HG11 VAL A 110 -0.039 7.033 0.728 1.00 14.24 H new ATOM 0 HG12 VAL A 110 -1.279 7.499 -0.461 1.00 14.24 H new ATOM 0 HG13 VAL A 110 0.412 7.293 -0.974 1.00 14.24 H new ATOM 0 HG21 VAL A 110 1.634 8.626 1.505 1.00 61.30 H new ATOM 0 HG22 VAL A 110 2.172 8.964 -0.158 1.00 61.30 H new ATOM 0 HG23 VAL A 110 1.667 10.300 0.903 1.00 61.30 H new ATOM 1672 N THR A 111 -1.939 9.464 -2.797 1.00 75.11 N ATOM 1673 CA THR A 111 -3.280 9.344 -3.386 1.00 75.22 C ATOM 1674 C THR A 111 -3.737 7.877 -3.436 1.00 71.30 C ATOM 1675 O THR A 111 -3.040 7.046 -4.020 1.00 71.00 O ATOM 1676 CB THR A 111 -3.285 9.931 -4.809 1.00 63.23 C ATOM 1677 OG1 THR A 111 -2.937 11.291 -4.800 1.00 33.03 O ATOM 1678 CG2 THR A 111 -4.643 9.871 -5.501 1.00 14.21 C ATOM 0 H THR A 111 -1.197 9.144 -3.420 1.00 75.11 H new ATOM 0 HA THR A 111 -3.974 9.901 -2.756 1.00 75.22 H new ATOM 0 HB THR A 111 -2.565 9.314 -5.346 1.00 63.23 H new ATOM 0 HG1 THR A 111 -2.947 11.637 -5.717 1.00 33.03 H new ATOM 0 HG21 THR A 111 -4.563 10.304 -6.498 1.00 14.21 H new ATOM 0 HG22 THR A 111 -4.965 8.833 -5.581 1.00 14.21 H new ATOM 0 HG23 THR A 111 -5.373 10.434 -4.919 1.00 14.21 H new ATOM 1686 N ILE A 112 -4.937 7.559 -2.935 1.00 0.11 N ATOM 1687 CA ILE A 112 -5.456 6.188 -2.770 1.00 41.32 C ATOM 1688 C ILE A 112 -6.794 6.084 -3.495 1.00 74.43 C ATOM 1689 O ILE A 112 -7.762 6.687 -3.031 1.00 60.43 O ATOM 1690 CB ILE A 112 -5.652 5.847 -1.273 1.00 4.04 C ATOM 1691 CG1 ILE A 112 -4.580 6.515 -0.396 1.00 32.32 C ATOM 1692 CG2 ILE A 112 -5.774 4.329 -1.079 1.00 64.54 C ATOM 1693 CD1 ILE A 112 -4.549 6.008 1.041 1.00 4.12 C ATOM 0 H ILE A 112 -5.598 8.270 -2.622 1.00 0.11 H new ATOM 0 HA ILE A 112 -4.738 5.482 -3.188 1.00 41.32 H new ATOM 0 HB ILE A 112 -6.596 6.271 -0.930 1.00 4.04 H new ATOM 0 HG12 ILE A 112 -3.602 6.352 -0.849 1.00 32.32 H new ATOM 0 HG13 ILE A 112 -4.752 7.591 -0.387 1.00 32.32 H new ATOM 0 HG21 ILE A 112 -5.911 4.107 -0.021 1.00 64.54 H new ATOM 0 HG22 ILE A 112 -6.631 3.958 -1.642 1.00 64.54 H new ATOM 0 HG23 ILE A 112 -4.867 3.842 -1.437 1.00 64.54 H new ATOM 0 HD11 ILE A 112 -3.767 6.528 1.594 1.00 4.12 H new ATOM 0 HD12 ILE A 112 -5.513 6.195 1.514 1.00 4.12 H new ATOM 0 HD13 ILE A 112 -4.345 4.937 1.045 1.00 4.12 H new ATOM 1705 N HIS A 113 -6.868 5.460 -4.668 1.00 55.41 N ATOM 1706 CA HIS A 113 -8.111 5.364 -5.435 1.00 64.20 C ATOM 1707 C HIS A 113 -9.033 4.285 -4.844 1.00 22.34 C ATOM 1708 O HIS A 113 -8.597 3.424 -4.080 1.00 61.44 O ATOM 1709 CB HIS A 113 -7.792 5.048 -6.902 1.00 34.05 C ATOM 1710 CG HIS A 113 -7.406 6.274 -7.683 1.00 15.35 C ATOM 1711 ND1 HIS A 113 -6.235 6.992 -7.569 1.00 2.43 N ATOM 1712 CD2 HIS A 113 -8.215 6.935 -8.566 1.00 14.13 C ATOM 1713 CE1 HIS A 113 -6.324 8.060 -8.375 1.00 62.32 C ATOM 1714 NE2 HIS A 113 -7.517 8.067 -8.992 1.00 62.34 N ATOM 0 H HIS A 113 -6.071 5.007 -5.114 1.00 55.41 H new ATOM 0 HA HIS A 113 -8.631 6.321 -5.381 1.00 64.20 H new ATOM 0 HB2 HIS A 113 -6.980 4.322 -6.946 1.00 34.05 H new ATOM 0 HB3 HIS A 113 -8.661 4.583 -7.368 1.00 34.05 H new ATOM 0 HD2 HIS A 113 -9.206 6.638 -8.875 1.00 14.13 H new ATOM 0 HE1 HIS A 113 -5.552 8.803 -8.508 1.00 62.32 H new ATOM 0 HE2 HIS A 113 -7.852 8.770 -9.651 1.00 62.34 H new ATOM 1722 N CYS A 114 -10.297 4.272 -5.268 1.00 35.32 N ATOM 1723 CA CYS A 114 -11.223 3.154 -5.134 1.00 24.31 C ATOM 1724 C CYS A 114 -11.861 2.913 -6.496 1.00 75.14 C ATOM 1725 O CYS A 114 -12.012 3.852 -7.281 1.00 63.42 O ATOM 1726 CB CYS A 114 -12.271 3.441 -4.053 1.00 62.30 C ATOM 1727 SG CYS A 114 -13.157 1.916 -3.604 1.00 62.51 S ATOM 0 H CYS A 114 -10.718 5.076 -5.734 1.00 35.32 H new ATOM 0 HA CYS A 114 -10.695 2.255 -4.817 1.00 24.31 H new ATOM 0 HB2 CYS A 114 -11.787 3.861 -3.171 1.00 62.30 H new ATOM 0 HB3 CYS A 114 -12.979 4.187 -4.413 1.00 62.30 H new ATOM 0 HG CYS A 114 -14.351 1.941 -4.118 1.00 62.51 H new ATOM 1733 N ASN A 115 -12.182 1.652 -6.790 1.00 4.34 N ATOM 1734 CA ASN A 115 -12.453 1.127 -8.115 1.00 64.22 C ATOM 1735 C ASN A 115 -13.668 0.189 -8.030 1.00 52.32 C ATOM 1736 O ASN A 115 -13.567 -1.004 -8.328 1.00 62.44 O ATOM 1737 CB ASN A 115 -11.184 0.401 -8.634 1.00 13.22 C ATOM 1738 CG ASN A 115 -9.865 1.067 -8.251 1.00 11.34 C ATOM 1739 OD1 ASN A 115 -9.190 0.675 -7.308 1.00 31.42 O ATOM 1740 ND2 ASN A 115 -9.504 2.142 -8.922 1.00 3.15 N ATOM 0 H ASN A 115 -12.262 0.937 -6.067 1.00 4.34 H new ATOM 0 HA ASN A 115 -12.691 1.923 -8.820 1.00 64.22 H new ATOM 0 HB2 ASN A 115 -11.184 -0.620 -8.251 1.00 13.22 H new ATOM 0 HB3 ASN A 115 -11.239 0.334 -9.721 1.00 13.22 H new ATOM 0 HD21 ASN A 115 -8.660 2.650 -8.656 1.00 3.15 H new ATOM 0 HD22 ASN A 115 -10.068 2.466 -9.707 1.00 3.15 H new ATOM 1747 N ASP A 116 -14.823 0.693 -7.582 1.00 71.44 N ATOM 1748 CA ASP A 116 -15.987 -0.129 -7.246 1.00 54.34 C ATOM 1749 C ASP A 116 -16.501 -0.912 -8.449 1.00 3.24 C ATOM 1750 O ASP A 116 -16.555 -0.402 -9.574 1.00 42.24 O ATOM 1751 CB ASP A 116 -17.137 0.731 -6.700 1.00 41.10 C ATOM 1752 CG ASP A 116 -17.077 0.872 -5.180 1.00 33.52 C ATOM 1753 OD1 ASP A 116 -16.115 1.499 -4.684 1.00 53.02 O ATOM 1754 OD2 ASP A 116 -17.951 0.316 -4.471 1.00 35.55 O ATOM 0 H ASP A 116 -14.976 1.692 -7.442 1.00 71.44 H new ATOM 0 HA ASP A 116 -15.652 -0.830 -6.481 1.00 54.34 H new ATOM 0 HB2 ASP A 116 -17.099 1.720 -7.157 1.00 41.10 H new ATOM 0 HB3 ASP A 116 -18.090 0.285 -6.985 1.00 41.10 H new ATOM 1759 N LYS A 117 -16.960 -2.137 -8.185 1.00 4.42 N ATOM 1760 CA LYS A 117 -17.605 -3.010 -9.166 1.00 23.43 C ATOM 1761 C LYS A 117 -19.037 -3.358 -8.755 1.00 41.02 C ATOM 1762 O LYS A 117 -19.643 -4.238 -9.364 1.00 51.10 O ATOM 1763 CB LYS A 117 -16.759 -4.277 -9.385 1.00 41.34 C ATOM 1764 CG LYS A 117 -15.278 -4.031 -9.711 1.00 51.20 C ATOM 1765 CD LYS A 117 -15.069 -3.256 -11.017 1.00 43.51 C ATOM 1766 CE LYS A 117 -13.571 -3.100 -11.289 1.00 52.23 C ATOM 1767 NZ LYS A 117 -13.283 -3.000 -12.733 1.00 3.22 N ATOM 0 H LYS A 117 -16.891 -2.559 -7.259 1.00 4.42 H new ATOM 0 HA LYS A 117 -17.670 -2.471 -10.111 1.00 23.43 H new ATOM 0 HB2 LYS A 117 -16.819 -4.893 -8.488 1.00 41.34 H new ATOM 0 HB3 LYS A 117 -17.202 -4.853 -10.197 1.00 41.34 H new ATOM 0 HG2 LYS A 117 -14.819 -3.479 -8.891 1.00 51.20 H new ATOM 0 HG3 LYS A 117 -14.763 -4.989 -9.778 1.00 51.20 H new ATOM 0 HD2 LYS A 117 -15.546 -3.782 -11.844 1.00 43.51 H new ATOM 0 HD3 LYS A 117 -15.540 -2.276 -10.949 1.00 43.51 H new ATOM 0 HE2 LYS A 117 -13.201 -2.209 -10.782 1.00 52.23 H new ATOM 0 HE3 LYS A 117 -13.035 -3.951 -10.870 1.00 52.23 H new ATOM 0 HZ1 LYS A 117 -12.258 -2.895 -12.876 1.00 3.22 H new ATOM 0 HZ2 LYS A 117 -13.614 -3.861 -13.213 1.00 3.22 H new ATOM 0 HZ3 LYS A 117 -13.774 -2.173 -13.128 1.00 3.22 H new ATOM 1781 N SER A 118 -19.580 -2.704 -7.728 1.00 40.01 N ATOM 1782 CA SER A 118 -20.997 -2.735 -7.436 1.00 30.31 C ATOM 1783 C SER A 118 -21.704 -1.857 -8.467 1.00 12.31 C ATOM 1784 O SER A 118 -22.397 -2.358 -9.345 1.00 41.22 O ATOM 1785 CB SER A 118 -21.215 -2.286 -5.990 1.00 44.03 C ATOM 1786 OG SER A 118 -20.555 -1.053 -5.766 1.00 42.03 O ATOM 0 H SER A 118 -19.038 -2.137 -7.076 1.00 40.01 H new ATOM 0 HA SER A 118 -21.418 -3.737 -7.513 1.00 30.31 H new ATOM 0 HB2 SER A 118 -22.281 -2.180 -5.789 1.00 44.03 H new ATOM 0 HB3 SER A 118 -20.835 -3.042 -5.303 1.00 44.03 H new ATOM 0 HG SER A 118 -20.699 -0.769 -4.839 1.00 42.03 H new ATOM 1792 N ASP A 119 -21.493 -0.546 -8.398 1.00 54.41 N ATOM 1793 CA ASP A 119 -22.308 0.471 -9.058 1.00 61.30 C ATOM 1794 C ASP A 119 -21.459 1.471 -9.843 1.00 11.21 C ATOM 1795 O ASP A 119 -21.782 2.651 -9.952 1.00 35.12 O ATOM 1796 CB ASP A 119 -23.278 1.106 -8.043 1.00 60.14 C ATOM 1797 CG ASP A 119 -24.697 0.790 -8.493 1.00 51.03 C ATOM 1798 OD1 ASP A 119 -25.201 1.462 -9.420 1.00 42.32 O ATOM 1799 OD2 ASP A 119 -25.233 -0.235 -8.016 1.00 74.30 O ATOM 0 H ASP A 119 -20.722 -0.147 -7.862 1.00 54.41 H new ATOM 0 HA ASP A 119 -22.926 -0.002 -9.821 1.00 61.30 H new ATOM 0 HB2 ASP A 119 -23.097 0.710 -7.043 1.00 60.14 H new ATOM 0 HB3 ASP A 119 -23.125 2.184 -7.992 1.00 60.14 H new ATOM 1804 N ASN A 120 -20.356 0.987 -10.419 1.00 23.03 N ATOM 1805 CA ASN A 120 -19.578 1.659 -11.460 1.00 20.04 C ATOM 1806 C ASN A 120 -19.084 3.033 -11.008 1.00 55.52 C ATOM 1807 O ASN A 120 -19.227 4.015 -11.741 1.00 40.12 O ATOM 1808 CB ASN A 120 -20.398 1.699 -12.763 1.00 3.14 C ATOM 1809 CG ASN A 120 -19.545 2.068 -13.970 1.00 32.15 C ATOM 1810 OD1 ASN A 120 -18.578 1.376 -14.276 1.00 15.53 O ATOM 1811 ND2 ASN A 120 -19.851 3.144 -14.672 1.00 22.32 N ATOM 0 H ASN A 120 -19.966 0.080 -10.162 1.00 23.03 H new ATOM 0 HA ASN A 120 -18.670 1.089 -11.657 1.00 20.04 H new ATOM 0 HB2 ASN A 120 -20.859 0.725 -12.930 1.00 3.14 H new ATOM 0 HB3 ASN A 120 -21.208 2.421 -12.658 1.00 3.14 H new ATOM 0 HD21 ASN A 120 -19.282 3.407 -15.477 1.00 22.32 H new ATOM 0 HD22 ASN A 120 -20.656 3.712 -14.410 1.00 22.32 H new ATOM 1818 N THR A 121 -18.511 3.116 -9.805 1.00 74.12 N ATOM 1819 CA THR A 121 -18.043 4.367 -9.226 1.00 21.02 C ATOM 1820 C THR A 121 -16.517 4.313 -9.198 1.00 24.22 C ATOM 1821 O THR A 121 -15.937 3.224 -9.271 1.00 23.31 O ATOM 1822 CB THR A 121 -18.700 4.648 -7.850 1.00 22.34 C ATOM 1823 OG1 THR A 121 -18.061 3.975 -6.786 1.00 62.34 O ATOM 1824 CG2 THR A 121 -20.179 4.243 -7.793 1.00 13.25 C ATOM 0 H THR A 121 -18.360 2.306 -9.204 1.00 74.12 H new ATOM 0 HA THR A 121 -18.347 5.220 -9.833 1.00 21.02 H new ATOM 0 HB THR A 121 -18.598 5.727 -7.737 1.00 22.34 H new ATOM 0 HG1 THR A 121 -18.515 4.189 -5.944 1.00 62.34 H new ATOM 0 HG21 THR A 121 -20.579 4.466 -6.804 1.00 13.25 H new ATOM 0 HG22 THR A 121 -20.738 4.800 -8.545 1.00 13.25 H new ATOM 0 HG23 THR A 121 -20.272 3.175 -7.990 1.00 13.25 H new ATOM 1832 N LYS A 122 -15.862 5.467 -9.115 1.00 23.05 N ATOM 1833 CA LYS A 122 -14.442 5.610 -8.789 1.00 12.54 C ATOM 1834 C LYS A 122 -14.278 6.922 -8.047 1.00 23.35 C ATOM 1835 O LYS A 122 -14.921 7.917 -8.395 1.00 41.50 O ATOM 1836 CB LYS A 122 -13.558 5.627 -10.051 1.00 40.11 C ATOM 1837 CG LYS A 122 -13.017 4.232 -10.415 1.00 14.54 C ATOM 1838 CD LYS A 122 -12.500 4.113 -11.848 1.00 24.11 C ATOM 1839 CE LYS A 122 -13.576 4.421 -12.899 1.00 12.13 C ATOM 1840 NZ LYS A 122 -14.628 3.385 -12.954 1.00 4.24 N ATOM 0 H LYS A 122 -16.320 6.363 -9.279 1.00 23.05 H new ATOM 0 HA LYS A 122 -14.127 4.759 -8.185 1.00 12.54 H new ATOM 0 HB2 LYS A 122 -14.135 6.019 -10.889 1.00 40.11 H new ATOM 0 HB3 LYS A 122 -12.721 6.308 -9.895 1.00 40.11 H new ATOM 0 HG2 LYS A 122 -12.210 3.977 -9.728 1.00 14.54 H new ATOM 0 HG3 LYS A 122 -13.808 3.498 -10.264 1.00 14.54 H new ATOM 0 HD2 LYS A 122 -11.661 4.795 -11.984 1.00 24.11 H new ATOM 0 HD3 LYS A 122 -12.120 3.104 -12.009 1.00 24.11 H new ATOM 0 HE2 LYS A 122 -14.032 5.385 -12.675 1.00 12.13 H new ATOM 0 HE3 LYS A 122 -13.107 4.510 -13.879 1.00 12.13 H new ATOM 0 HZ1 LYS A 122 -15.329 3.640 -13.679 1.00 4.24 H new ATOM 0 HZ2 LYS A 122 -14.200 2.468 -13.194 1.00 4.24 H new ATOM 0 HZ3 LYS A 122 -15.096 3.316 -12.028 1.00 4.24 H new ATOM 1854 N SER A 123 -13.367 6.940 -7.086 1.00 4.13 N ATOM 1855 CA SER A 123 -12.916 8.132 -6.390 1.00 12.22 C ATOM 1856 C SER A 123 -11.511 7.855 -5.874 1.00 40.34 C ATOM 1857 O SER A 123 -10.888 6.865 -6.271 1.00 71.01 O ATOM 1858 CB SER A 123 -13.920 8.480 -5.284 1.00 61.53 C ATOM 1859 OG SER A 123 -13.676 9.745 -4.713 1.00 11.41 O ATOM 0 H SER A 123 -12.905 6.092 -6.758 1.00 4.13 H new ATOM 0 HA SER A 123 -12.869 9.004 -7.043 1.00 12.22 H new ATOM 0 HB2 SER A 123 -14.930 8.459 -5.694 1.00 61.53 H new ATOM 0 HB3 SER A 123 -13.876 7.719 -4.505 1.00 61.53 H new ATOM 0 HG SER A 123 -13.213 9.633 -3.856 1.00 11.41 H new ATOM 1865 N SER A 124 -10.992 8.731 -5.020 1.00 33.24 N ATOM 1866 CA SER A 124 -9.735 8.547 -4.332 1.00 41.20 C ATOM 1867 C SER A 124 -9.735 9.410 -3.057 1.00 32.11 C ATOM 1868 O SER A 124 -10.705 10.140 -2.825 1.00 64.14 O ATOM 1869 CB SER A 124 -8.619 8.854 -5.340 1.00 51.30 C ATOM 1870 OG SER A 124 -7.337 8.658 -4.817 1.00 12.03 O ATOM 0 H SER A 124 -11.453 9.610 -4.786 1.00 33.24 H new ATOM 0 HA SER A 124 -9.571 7.528 -3.982 1.00 41.20 H new ATOM 0 HB2 SER A 124 -8.747 8.221 -6.218 1.00 51.30 H new ATOM 0 HB3 SER A 124 -8.714 9.887 -5.675 1.00 51.30 H new ATOM 0 HG SER A 124 -7.109 9.403 -4.222 1.00 12.03 H new ATOM 1876 N VAL A 125 -8.676 9.347 -2.238 1.00 52.20 N ATOM 1877 CA VAL A 125 -8.403 10.368 -1.238 1.00 31.43 C ATOM 1878 C VAL A 125 -6.976 10.854 -1.390 1.00 23.15 C ATOM 1879 O VAL A 125 -6.173 10.170 -2.035 1.00 61.34 O ATOM 1880 CB VAL A 125 -8.686 9.883 0.200 1.00 32.14 C ATOM 1881 CG1 VAL A 125 -10.051 9.220 0.389 1.00 34.55 C ATOM 1882 CG2 VAL A 125 -7.627 8.915 0.739 1.00 72.43 C ATOM 0 H VAL A 125 -7.994 8.589 -2.256 1.00 52.20 H new ATOM 0 HA VAL A 125 -9.086 11.200 -1.410 1.00 31.43 H new ATOM 0 HB VAL A 125 -8.663 10.814 0.766 1.00 32.14 H new ATOM 0 HG11 VAL A 125 -10.164 8.911 1.428 1.00 34.55 H new ATOM 0 HG12 VAL A 125 -10.838 9.929 0.133 1.00 34.55 H new ATOM 0 HG13 VAL A 125 -10.124 8.347 -0.260 1.00 34.55 H new ATOM 0 HG21 VAL A 125 -7.890 8.616 1.754 1.00 72.43 H new ATOM 0 HG22 VAL A 125 -7.582 8.033 0.101 1.00 72.43 H new ATOM 0 HG23 VAL A 125 -6.654 9.407 0.747 1.00 72.43 H new ATOM 1892 N SER A 126 -6.663 11.994 -0.771 1.00 3.04 N ATOM 1893 CA SER A 126 -5.321 12.563 -0.877 1.00 51.02 C ATOM 1894 C SER A 126 -5.015 13.592 0.220 1.00 55.33 C ATOM 1895 O SER A 126 -5.822 14.478 0.534 1.00 22.23 O ATOM 1896 CB SER A 126 -5.110 13.139 -2.291 1.00 14.25 C ATOM 1897 OG SER A 126 -6.258 13.825 -2.766 1.00 23.13 O ATOM 0 H SER A 126 -7.312 12.534 -0.199 1.00 3.04 H new ATOM 0 HA SER A 126 -4.605 11.757 -0.717 1.00 51.02 H new ATOM 0 HB2 SER A 126 -4.260 13.821 -2.281 1.00 14.25 H new ATOM 0 HB3 SER A 126 -4.862 12.330 -2.978 1.00 14.25 H new ATOM 0 HG SER A 126 -6.081 14.176 -3.664 1.00 23.13 H new ATOM 1903 N GLY A 127 -3.810 13.490 0.784 1.00 53.13 N ATOM 1904 CA GLY A 127 -3.282 14.426 1.769 1.00 15.43 C ATOM 1905 C GLY A 127 -1.755 14.410 1.776 1.00 44.00 C ATOM 1906 O GLY A 127 -1.140 13.472 1.250 1.00 14.11 O ATOM 0 H GLY A 127 -3.161 12.735 0.561 1.00 53.13 H new ATOM 0 HA2 GLY A 127 -3.638 15.432 1.547 1.00 15.43 H new ATOM 0 HA3 GLY A 127 -3.656 14.167 2.759 1.00 15.43 H new ATOM 1910 N LYS A 128 -1.144 15.439 2.374 1.00 52.43 N ATOM 1911 CA LYS A 128 0.301 15.554 2.548 1.00 34.35 C ATOM 1912 C LYS A 128 0.735 14.661 3.697 1.00 63.52 C ATOM 1913 O LYS A 128 0.043 14.563 4.709 1.00 22.32 O ATOM 1914 CB LYS A 128 0.730 17.000 2.865 1.00 40.40 C ATOM 1915 CG LYS A 128 0.871 17.921 1.639 1.00 34.41 C ATOM 1916 CD LYS A 128 -0.199 19.019 1.541 1.00 14.41 C ATOM 1917 CE LYS A 128 -1.561 18.532 1.024 1.00 54.13 C ATOM 1918 NZ LYS A 128 -1.629 18.483 -0.453 1.00 15.15 N ATOM 0 H LYS A 128 -1.657 16.232 2.758 1.00 52.43 H new ATOM 0 HA LYS A 128 0.773 15.253 1.613 1.00 34.35 H new ATOM 0 HB2 LYS A 128 0.001 17.438 3.547 1.00 40.40 H new ATOM 0 HB3 LYS A 128 1.684 16.973 3.392 1.00 40.40 H new ATOM 0 HG2 LYS A 128 1.854 18.391 1.664 1.00 34.41 H new ATOM 0 HG3 LYS A 128 0.832 17.312 0.736 1.00 34.41 H new ATOM 0 HD2 LYS A 128 -0.336 19.465 2.526 1.00 14.41 H new ATOM 0 HD3 LYS A 128 0.166 19.807 0.882 1.00 14.41 H new ATOM 0 HE2 LYS A 128 -1.763 17.539 1.426 1.00 54.13 H new ATOM 0 HE3 LYS A 128 -2.344 19.192 1.398 1.00 54.13 H new ATOM 0 HZ1 LYS A 128 -2.530 18.053 -0.745 1.00 15.15 H new ATOM 0 HZ2 LYS A 128 -1.566 19.448 -0.836 1.00 15.15 H new ATOM 0 HZ3 LYS A 128 -0.839 17.913 -0.818 1.00 15.15 H new ATOM 1932 N VAL A 129 1.927 14.078 3.591 1.00 15.02 N ATOM 1933 CA VAL A 129 2.560 13.393 4.706 1.00 0.32 C ATOM 1934 C VAL A 129 2.804 14.428 5.805 1.00 55.42 C ATOM 1935 O VAL A 129 3.613 15.348 5.643 1.00 74.43 O ATOM 1936 CB VAL A 129 3.864 12.695 4.276 1.00 53.21 C ATOM 1937 CG1 VAL A 129 4.450 11.873 5.433 1.00 22.41 C ATOM 1938 CG2 VAL A 129 3.661 11.736 3.098 1.00 0.23 C ATOM 0 H VAL A 129 2.476 14.069 2.732 1.00 15.02 H new ATOM 0 HA VAL A 129 1.910 12.602 5.079 1.00 0.32 H new ATOM 0 HB VAL A 129 4.540 13.496 3.977 1.00 53.21 H new ATOM 0 HG11 VAL A 129 5.370 11.389 5.106 1.00 22.41 H new ATOM 0 HG12 VAL A 129 4.665 12.531 6.275 1.00 22.41 H new ATOM 0 HG13 VAL A 129 3.731 11.114 5.741 1.00 22.41 H new ATOM 0 HG21 VAL A 129 4.613 11.273 2.838 1.00 0.23 H new ATOM 0 HG22 VAL A 129 2.945 10.963 3.377 1.00 0.23 H new ATOM 0 HG23 VAL A 129 3.280 12.290 2.240 1.00 0.23 H new ATOM 1948 N GLY A 130 2.085 14.265 6.912 1.00 52.41 N ATOM 1949 CA GLY A 130 2.167 15.080 8.108 1.00 33.52 C ATOM 1950 C GLY A 130 0.822 15.726 8.418 1.00 13.41 C ATOM 1951 O GLY A 130 0.450 15.801 9.589 1.00 0.32 O ATOM 0 H GLY A 130 1.394 13.519 6.998 1.00 52.41 H new ATOM 0 HA2 GLY A 130 2.483 14.465 8.951 1.00 33.52 H new ATOM 0 HA3 GLY A 130 2.924 15.853 7.975 1.00 33.52 H new ATOM 1955 N ALA A 131 0.079 16.140 7.390 1.00 14.13 N ATOM 1956 CA ALA A 131 -1.181 16.855 7.540 1.00 20.22 C ATOM 1957 C ALA A 131 -2.341 15.891 7.822 1.00 24.25 C ATOM 1958 O ALA A 131 -2.160 14.676 7.941 1.00 75.51 O ATOM 1959 CB ALA A 131 -1.423 17.669 6.261 1.00 72.50 C ATOM 0 H ALA A 131 0.343 15.984 6.417 1.00 14.13 H new ATOM 0 HA ALA A 131 -1.126 17.526 8.397 1.00 20.22 H new ATOM 0 HB1 ALA A 131 -2.363 18.214 6.349 1.00 72.50 H new ATOM 0 HB2 ALA A 131 -0.605 18.376 6.119 1.00 72.50 H new ATOM 0 HB3 ALA A 131 -1.473 16.996 5.405 1.00 72.50 H new ATOM 1965 N ASP A 132 -3.542 16.458 7.911 1.00 32.45 N ATOM 1966 CA ASP A 132 -4.798 15.791 7.596 1.00 60.14 C ATOM 1967 C ASP A 132 -4.917 15.561 6.084 1.00 55.03 C ATOM 1968 O ASP A 132 -3.944 15.686 5.334 1.00 2.11 O ATOM 1969 CB ASP A 132 -5.973 16.612 8.148 1.00 71.34 C ATOM 1970 CG ASP A 132 -7.175 15.710 8.383 1.00 3.32 C ATOM 1971 OD1 ASP A 132 -7.104 14.902 9.334 1.00 20.15 O ATOM 1972 OD2 ASP A 132 -8.134 15.747 7.587 1.00 40.30 O ATOM 0 H ASP A 132 -3.669 17.424 8.214 1.00 32.45 H new ATOM 0 HA ASP A 132 -4.821 14.811 8.073 1.00 60.14 H new ATOM 0 HB2 ASP A 132 -5.683 17.095 9.081 1.00 71.34 H new ATOM 0 HB3 ASP A 132 -6.235 17.404 7.447 1.00 71.34 H new ATOM 1977 N LEU A 133 -6.108 15.210 5.610 1.00 54.12 N ATOM 1978 CA LEU A 133 -6.432 15.191 4.194 1.00 35.25 C ATOM 1979 C LEU A 133 -6.925 16.584 3.773 1.00 0.14 C ATOM 1980 O LEU A 133 -7.275 17.414 4.616 1.00 43.13 O ATOM 1981 CB LEU A 133 -7.484 14.095 3.992 1.00 62.22 C ATOM 1982 CG LEU A 133 -6.862 12.678 4.048 1.00 24.34 C ATOM 1983 CD1 LEU A 133 -7.395 11.817 5.178 1.00 2.11 C ATOM 1984 CD2 LEU A 133 -7.157 11.930 2.756 1.00 53.44 C ATOM 0 H LEU A 133 -6.883 14.927 6.209 1.00 54.12 H new ATOM 0 HA LEU A 133 -5.569 14.966 3.568 1.00 35.25 H new ATOM 0 HB2 LEU A 133 -8.253 14.184 4.760 1.00 62.22 H new ATOM 0 HB3 LEU A 133 -7.976 14.237 3.030 1.00 62.22 H new ATOM 0 HG LEU A 133 -5.796 12.840 4.206 1.00 24.34 H new ATOM 0 HD11 LEU A 133 -6.912 10.840 5.151 1.00 2.11 H new ATOM 0 HD12 LEU A 133 -7.185 12.299 6.133 1.00 2.11 H new ATOM 0 HD13 LEU A 133 -8.472 11.692 5.063 1.00 2.11 H new ATOM 0 HD21 LEU A 133 -6.716 10.934 2.803 1.00 53.44 H new ATOM 0 HD22 LEU A 133 -8.235 11.843 2.624 1.00 53.44 H new ATOM 0 HD23 LEU A 133 -6.731 12.476 1.914 1.00 53.44 H new ATOM 1996 N THR A 134 -6.945 16.855 2.468 1.00 52.02 N ATOM 1997 CA THR A 134 -7.550 18.062 1.877 1.00 4.04 C ATOM 1998 C THR A 134 -8.583 17.662 0.806 1.00 60.23 C ATOM 1999 O THR A 134 -9.252 18.503 0.196 1.00 51.02 O ATOM 2000 CB THR A 134 -6.429 19.006 1.374 1.00 21.35 C ATOM 2001 OG1 THR A 134 -6.935 20.263 0.951 1.00 64.44 O ATOM 2002 CG2 THR A 134 -5.590 18.384 0.253 1.00 15.12 C ATOM 0 H THR A 134 -6.534 16.232 1.773 1.00 52.02 H new ATOM 0 HA THR A 134 -8.109 18.628 2.623 1.00 4.04 H new ATOM 0 HB THR A 134 -5.779 19.164 2.235 1.00 21.35 H new ATOM 0 HG1 THR A 134 -7.787 20.132 0.484 1.00 64.44 H new ATOM 0 HG21 THR A 134 -4.821 19.090 -0.060 1.00 15.12 H new ATOM 0 HG22 THR A 134 -5.119 17.470 0.615 1.00 15.12 H new ATOM 0 HG23 THR A 134 -6.233 18.149 -0.595 1.00 15.12 H new ATOM 2010 N SER A 135 -8.711 16.363 0.534 1.00 4.25 N ATOM 2011 CA SER A 135 -9.497 15.790 -0.531 1.00 62.22 C ATOM 2012 C SER A 135 -9.757 14.339 -0.140 1.00 43.41 C ATOM 2013 O SER A 135 -8.881 13.680 0.426 1.00 2.23 O ATOM 2014 CB SER A 135 -8.672 15.902 -1.819 1.00 60.30 C ATOM 2015 OG SER A 135 -8.534 17.265 -2.193 1.00 2.31 O ATOM 0 H SER A 135 -8.237 15.651 1.090 1.00 4.25 H new ATOM 0 HA SER A 135 -10.450 16.293 -0.693 1.00 62.22 H new ATOM 0 HB2 SER A 135 -7.688 15.456 -1.670 1.00 60.30 H new ATOM 0 HB3 SER A 135 -9.157 15.344 -2.620 1.00 60.30 H new ATOM 0 HG SER A 135 -8.004 17.327 -3.015 1.00 2.31 H new ATOM 2021 N GLY A 136 -10.949 13.823 -0.426 1.00 13.41 N ATOM 2022 CA GLY A 136 -11.258 12.415 -0.241 1.00 72.11 C ATOM 2023 C GLY A 136 -11.914 12.065 1.088 1.00 72.13 C ATOM 2024 O GLY A 136 -12.719 11.135 1.167 1.00 72.13 O ATOM 0 H GLY A 136 -11.726 14.373 -0.793 1.00 13.41 H new ATOM 0 HA2 GLY A 136 -11.916 12.095 -1.049 1.00 72.11 H new ATOM 0 HA3 GLY A 136 -10.336 11.842 -0.335 1.00 72.11 H new ATOM 2028 N ASN A 137 -11.496 12.741 2.152 1.00 20.11 N ATOM 2029 CA ASN A 137 -11.890 12.440 3.519 1.00 22.54 C ATOM 2030 C ASN A 137 -13.349 12.791 3.773 1.00 54.13 C ATOM 2031 O ASN A 137 -13.886 13.711 3.157 1.00 71.54 O ATOM 2032 CB ASN A 137 -10.945 13.129 4.490 1.00 71.23 C ATOM 2033 CG ASN A 137 -10.987 14.628 4.348 1.00 15.11 C ATOM 2034 OD1 ASN A 137 -10.530 15.197 3.356 1.00 34.23 O ATOM 2035 ND2 ASN A 137 -11.535 15.299 5.322 1.00 15.13 N ATOM 0 H ASN A 137 -10.857 13.533 2.084 1.00 20.11 H new ATOM 0 HA ASN A 137 -11.810 11.365 3.681 1.00 22.54 H new ATOM 0 HB2 ASN A 137 -11.210 12.854 5.511 1.00 71.23 H new ATOM 0 HB3 ASN A 137 -9.928 12.777 4.318 1.00 71.23 H new ATOM 0 HD21 ASN A 137 -11.592 16.316 5.272 1.00 15.13 H new ATOM 0 HD22 ASN A 137 -11.907 14.807 6.134 1.00 15.13 H new ATOM 2042 N GLY A 138 -13.974 12.043 4.683 1.00 23.44 N ATOM 2043 CA GLY A 138 -15.403 12.067 4.975 1.00 33.32 C ATOM 2044 C GLY A 138 -16.073 10.793 4.455 1.00 15.24 C ATOM 2045 O GLY A 138 -16.922 10.207 5.127 1.00 55.42 O ATOM 0 H GLY A 138 -13.471 11.372 5.263 1.00 23.44 H new ATOM 0 HA2 GLY A 138 -15.560 12.156 6.050 1.00 33.32 H new ATOM 0 HA3 GLY A 138 -15.861 12.941 4.513 1.00 33.32 H new ATOM 2049 N THR A 139 -15.637 10.325 3.288 1.00 54.23 N ATOM 2050 CA THR A 139 -16.218 9.252 2.484 1.00 35.54 C ATOM 2051 C THR A 139 -16.105 7.871 3.171 1.00 62.14 C ATOM 2052 O THR A 139 -15.381 7.706 4.162 1.00 42.34 O ATOM 2053 CB THR A 139 -15.488 9.294 1.118 1.00 52.24 C ATOM 2054 OG1 THR A 139 -15.255 10.634 0.718 1.00 41.31 O ATOM 2055 CG2 THR A 139 -16.269 8.669 -0.044 1.00 4.43 C ATOM 0 H THR A 139 -14.805 10.716 2.846 1.00 54.23 H new ATOM 0 HA THR A 139 -17.290 9.402 2.356 1.00 35.54 H new ATOM 0 HB THR A 139 -14.576 8.724 1.295 1.00 52.24 H new ATOM 0 HG1 THR A 139 -14.327 10.878 0.916 1.00 41.31 H new ATOM 0 HG21 THR A 139 -15.681 8.744 -0.959 1.00 4.43 H new ATOM 0 HG22 THR A 139 -16.469 7.620 0.174 1.00 4.43 H new ATOM 0 HG23 THR A 139 -17.213 9.199 -0.175 1.00 4.43 H new ATOM 2063 N THR A 140 -16.763 6.843 2.627 1.00 45.43 N ATOM 2064 CA THR A 140 -16.433 5.449 2.906 1.00 14.34 C ATOM 2065 C THR A 140 -16.582 4.591 1.646 1.00 43.14 C ATOM 2066 O THR A 140 -17.344 4.941 0.734 1.00 52.40 O ATOM 2067 CB THR A 140 -17.264 4.940 4.104 1.00 52.04 C ATOM 2068 OG1 THR A 140 -16.927 3.610 4.445 1.00 53.32 O ATOM 2069 CG2 THR A 140 -18.777 4.971 3.848 1.00 23.11 C ATOM 0 H THR A 140 -17.542 6.959 1.979 1.00 45.43 H new ATOM 0 HA THR A 140 -15.385 5.369 3.196 1.00 14.34 H new ATOM 0 HB THR A 140 -17.021 5.625 4.917 1.00 52.04 H new ATOM 0 HG1 THR A 140 -15.999 3.431 4.187 1.00 53.32 H new ATOM 0 HG21 THR A 140 -19.303 4.601 4.728 1.00 23.11 H new ATOM 0 HG22 THR A 140 -19.090 5.994 3.642 1.00 23.11 H new ATOM 0 HG23 THR A 140 -19.014 4.340 2.992 1.00 23.11 H new ATOM 2077 N PHE A 141 -15.866 3.463 1.619 1.00 32.32 N ATOM 2078 CA PHE A 141 -15.863 2.437 0.587 1.00 43.03 C ATOM 2079 C PHE A 141 -15.625 1.058 1.212 1.00 14.43 C ATOM 2080 O PHE A 141 -15.238 0.909 2.374 1.00 61.40 O ATOM 2081 CB PHE A 141 -14.761 2.740 -0.439 1.00 44.40 C ATOM 2082 CG PHE A 141 -15.052 3.867 -1.409 1.00 0.11 C ATOM 2083 CD1 PHE A 141 -16.278 3.935 -2.101 1.00 15.03 C ATOM 2084 CD2 PHE A 141 -14.061 4.832 -1.655 1.00 72.54 C ATOM 2085 CE1 PHE A 141 -16.529 4.978 -3.006 1.00 12.23 C ATOM 2086 CE2 PHE A 141 -14.315 5.876 -2.560 1.00 62.14 C ATOM 2087 CZ PHE A 141 -15.546 5.952 -3.234 1.00 53.14 C ATOM 0 H PHE A 141 -15.226 3.231 2.379 1.00 32.32 H new ATOM 0 HA PHE A 141 -16.832 2.434 0.087 1.00 43.03 H new ATOM 0 HB2 PHE A 141 -13.845 2.979 0.101 1.00 44.40 H new ATOM 0 HB3 PHE A 141 -14.566 1.834 -1.013 1.00 44.40 H new ATOM 0 HD1 PHE A 141 -17.030 3.178 -1.934 1.00 15.03 H new ATOM 0 HD2 PHE A 141 -13.108 4.771 -1.151 1.00 72.54 H new ATOM 0 HE1 PHE A 141 -17.475 5.030 -3.525 1.00 12.23 H new ATOM 0 HE2 PHE A 141 -13.559 6.626 -2.739 1.00 62.14 H new ATOM 0 HZ PHE A 141 -15.735 6.759 -3.926 1.00 53.14 H new ATOM 2097 N LYS A 142 -15.819 0.006 0.426 1.00 42.11 N ATOM 2098 CA LYS A 142 -15.553 -1.362 0.833 1.00 11.25 C ATOM 2099 C LYS A 142 -14.064 -1.655 0.690 1.00 70.20 C ATOM 2100 O LYS A 142 -13.497 -1.393 -0.370 1.00 74.40 O ATOM 2101 CB LYS A 142 -16.396 -2.319 -0.012 1.00 44.23 C ATOM 2102 CG LYS A 142 -17.898 -2.061 0.188 1.00 71.30 C ATOM 2103 CD LYS A 142 -18.817 -3.042 -0.552 1.00 4.41 C ATOM 2104 CE LYS A 142 -20.136 -3.136 0.229 1.00 44.24 C ATOM 2105 NZ LYS A 142 -21.094 -4.109 -0.330 1.00 30.32 N ATOM 0 H LYS A 142 -16.172 0.084 -0.528 1.00 42.11 H new ATOM 0 HA LYS A 142 -15.827 -1.503 1.879 1.00 11.25 H new ATOM 0 HB2 LYS A 142 -16.141 -2.200 -1.065 1.00 44.23 H new ATOM 0 HB3 LYS A 142 -16.162 -3.349 0.258 1.00 44.23 H new ATOM 0 HG2 LYS A 142 -18.123 -2.106 1.254 1.00 71.30 H new ATOM 0 HG3 LYS A 142 -18.127 -1.048 -0.143 1.00 71.30 H new ATOM 0 HD2 LYS A 142 -19.000 -2.699 -1.570 1.00 4.41 H new ATOM 0 HD3 LYS A 142 -18.347 -4.023 -0.626 1.00 4.41 H new ATOM 0 HE2 LYS A 142 -19.917 -3.409 1.261 1.00 44.24 H new ATOM 0 HE3 LYS A 142 -20.604 -2.152 0.252 1.00 44.24 H new ATOM 0 HZ1 LYS A 142 -21.958 -4.117 0.249 1.00 30.32 H new ATOM 0 HZ2 LYS A 142 -21.333 -3.840 -1.306 1.00 30.32 H new ATOM 0 HZ3 LYS A 142 -20.667 -5.057 -0.327 1.00 30.32 H new ATOM 2119 N LYS A 143 -13.465 -2.308 1.697 1.00 12.22 N ATOM 2120 CA LYS A 143 -12.067 -2.773 1.695 1.00 10.01 C ATOM 2121 C LYS A 143 -11.760 -3.494 0.385 1.00 23.23 C ATOM 2122 O LYS A 143 -10.751 -3.244 -0.275 1.00 21.34 O ATOM 2123 CB LYS A 143 -11.816 -3.639 2.960 1.00 52.03 C ATOM 2124 CG LYS A 143 -10.498 -4.452 3.000 1.00 33.34 C ATOM 2125 CD LYS A 143 -9.923 -4.681 4.422 1.00 31.11 C ATOM 2126 CE LYS A 143 -9.870 -6.135 4.922 1.00 3.31 C ATOM 2127 NZ LYS A 143 -9.430 -6.245 6.341 1.00 50.01 N ATOM 0 H LYS A 143 -13.954 -2.535 2.563 1.00 12.22 H new ATOM 0 HA LYS A 143 -11.376 -1.931 1.745 1.00 10.01 H new ATOM 0 HB2 LYS A 143 -11.837 -2.983 3.830 1.00 52.03 H new ATOM 0 HB3 LYS A 143 -12.648 -4.335 3.066 1.00 52.03 H new ATOM 0 HG2 LYS A 143 -10.670 -5.421 2.532 1.00 33.34 H new ATOM 0 HG3 LYS A 143 -9.750 -3.936 2.399 1.00 33.34 H new ATOM 0 HD2 LYS A 143 -8.912 -4.275 4.449 1.00 31.11 H new ATOM 0 HD3 LYS A 143 -10.518 -4.101 5.127 1.00 31.11 H new ATOM 0 HE2 LYS A 143 -10.857 -6.586 4.817 1.00 3.31 H new ATOM 0 HE3 LYS A 143 -9.189 -6.706 4.291 1.00 3.31 H new ATOM 0 HZ1 LYS A 143 -9.957 -7.009 6.810 1.00 50.01 H new ATOM 0 HZ2 LYS A 143 -8.412 -6.456 6.373 1.00 50.01 H new ATOM 0 HZ3 LYS A 143 -9.613 -5.347 6.832 1.00 50.01 H new ATOM 2141 N ARG A 144 -12.680 -4.354 -0.060 1.00 10.04 N ATOM 2142 CA ARG A 144 -12.452 -5.157 -1.250 1.00 12.45 C ATOM 2143 C ARG A 144 -12.246 -4.363 -2.550 1.00 53.14 C ATOM 2144 O ARG A 144 -11.592 -4.900 -3.441 1.00 30.44 O ATOM 2145 CB ARG A 144 -13.475 -6.293 -1.350 1.00 1.31 C ATOM 2146 CG ARG A 144 -14.954 -5.918 -1.564 1.00 10.33 C ATOM 2147 CD ARG A 144 -15.889 -7.092 -1.201 1.00 12.25 C ATOM 2148 NE ARG A 144 -15.563 -8.323 -1.945 1.00 52.32 N ATOM 2149 CZ ARG A 144 -14.595 -9.178 -1.612 1.00 52.13 C ATOM 2150 NH1 ARG A 144 -14.287 -9.381 -0.333 1.00 61.10 N ATOM 2151 NH2 ARG A 144 -13.910 -9.767 -2.581 1.00 23.25 N ATOM 0 H ARG A 144 -13.584 -4.507 0.388 1.00 10.04 H new ATOM 0 HA ARG A 144 -11.474 -5.621 -1.119 1.00 12.45 H new ATOM 0 HB2 ARG A 144 -13.173 -6.943 -2.171 1.00 1.31 H new ATOM 0 HB3 ARG A 144 -13.409 -6.883 -0.436 1.00 1.31 H new ATOM 0 HG2 ARG A 144 -15.203 -5.050 -0.954 1.00 10.33 H new ATOM 0 HG3 ARG A 144 -15.112 -5.633 -2.604 1.00 10.33 H new ATOM 0 HD2 ARG A 144 -15.821 -7.289 -0.131 1.00 12.25 H new ATOM 0 HD3 ARG A 144 -16.921 -6.808 -1.408 1.00 12.25 H new ATOM 0 HE ARG A 144 -16.118 -8.536 -2.774 1.00 52.32 H new ATOM 0 HH11 ARG A 144 -14.792 -8.881 0.399 1.00 61.10 H new ATOM 0 HH12 ARG A 144 -13.546 -10.036 -0.085 1.00 61.10 H new ATOM 0 HH21 ARG A 144 -14.128 -9.563 -3.556 1.00 23.25 H new ATOM 0 HH22 ARG A 144 -13.165 -10.425 -2.352 1.00 23.25 H new ATOM 2165 N PHE A 145 -12.678 -3.101 -2.667 1.00 23.22 N ATOM 2166 CA PHE A 145 -12.673 -2.360 -3.937 1.00 74.33 C ATOM 2167 C PHE A 145 -11.543 -1.315 -4.071 1.00 71.22 C ATOM 2168 O PHE A 145 -11.472 -0.618 -5.086 1.00 33.55 O ATOM 2169 CB PHE A 145 -14.065 -1.731 -4.151 1.00 52.30 C ATOM 2170 CG PHE A 145 -15.230 -2.678 -4.448 1.00 4.15 C ATOM 2171 CD1 PHE A 145 -15.087 -3.756 -5.344 1.00 54.30 C ATOM 2172 CD2 PHE A 145 -16.507 -2.415 -3.915 1.00 74.23 C ATOM 2173 CE1 PHE A 145 -16.200 -4.528 -5.718 1.00 2.41 C ATOM 2174 CE2 PHE A 145 -17.629 -3.162 -4.319 1.00 1.05 C ATOM 2175 CZ PHE A 145 -17.478 -4.214 -5.235 1.00 5.21 C ATOM 0 H PHE A 145 -13.042 -2.562 -1.881 1.00 23.22 H new ATOM 0 HA PHE A 145 -12.457 -3.079 -4.728 1.00 74.33 H new ATOM 0 HB2 PHE A 145 -14.316 -1.158 -3.258 1.00 52.30 H new ATOM 0 HB3 PHE A 145 -13.990 -1.021 -4.975 1.00 52.30 H new ATOM 0 HD1 PHE A 145 -14.113 -3.991 -5.747 1.00 54.30 H new ATOM 0 HD2 PHE A 145 -16.627 -1.628 -3.185 1.00 74.23 H new ATOM 0 HE1 PHE A 145 -16.070 -5.369 -6.382 1.00 2.41 H new ATOM 0 HE2 PHE A 145 -18.606 -2.926 -3.924 1.00 1.05 H new ATOM 0 HZ PHE A 145 -18.339 -4.777 -5.565 1.00 5.21 H new ATOM 2185 N ILE A 146 -10.657 -1.175 -3.078 1.00 1.41 N ATOM 2186 CA ILE A 146 -9.592 -0.160 -3.069 1.00 50.40 C ATOM 2187 C ILE A 146 -8.319 -0.765 -3.677 1.00 61.52 C ATOM 2188 O ILE A 146 -7.582 -1.452 -2.974 1.00 1.34 O ATOM 2189 CB ILE A 146 -9.435 0.373 -1.617 1.00 52.10 C ATOM 2190 CG1 ILE A 146 -10.704 1.195 -1.287 1.00 1.41 C ATOM 2191 CG2 ILE A 146 -8.182 1.244 -1.390 1.00 70.11 C ATOM 2192 CD1 ILE A 146 -10.829 1.691 0.151 1.00 71.40 C ATOM 0 H ILE A 146 -10.658 -1.769 -2.248 1.00 1.41 H new ATOM 0 HA ILE A 146 -9.833 0.704 -3.689 1.00 50.40 H new ATOM 0 HB ILE A 146 -9.311 -0.488 -0.961 1.00 52.10 H new ATOM 0 HG12 ILE A 146 -10.736 2.058 -1.951 1.00 1.41 H new ATOM 0 HG13 ILE A 146 -11.577 0.584 -1.516 1.00 1.41 H new ATOM 0 HG21 ILE A 146 -8.151 1.573 -0.351 1.00 70.11 H new ATOM 0 HG22 ILE A 146 -7.288 0.661 -1.613 1.00 70.11 H new ATOM 0 HG23 ILE A 146 -8.220 2.114 -2.045 1.00 70.11 H new ATOM 0 HD11 ILE A 146 -11.756 2.253 0.263 1.00 71.40 H new ATOM 0 HD12 ILE A 146 -10.837 0.839 0.830 1.00 71.40 H new ATOM 0 HD13 ILE A 146 -9.983 2.336 0.388 1.00 71.40 H new ATOM 2204 N ASP A 147 -8.068 -0.608 -4.979 1.00 71.52 N ATOM 2205 CA ASP A 147 -6.903 -1.185 -5.661 1.00 5.32 C ATOM 2206 C ASP A 147 -6.349 -0.243 -6.745 1.00 64.21 C ATOM 2207 O ASP A 147 -6.327 -0.549 -7.939 1.00 42.11 O ATOM 2208 CB ASP A 147 -7.115 -2.653 -6.127 1.00 71.31 C ATOM 2209 CG ASP A 147 -8.554 -3.143 -6.287 1.00 12.54 C ATOM 2210 OD1 ASP A 147 -9.231 -2.795 -7.273 1.00 10.43 O ATOM 2211 OD2 ASP A 147 -8.996 -3.920 -5.395 1.00 31.12 O ATOM 0 H ASP A 147 -8.674 -0.070 -5.598 1.00 71.52 H new ATOM 0 HA ASP A 147 -6.114 -1.269 -4.914 1.00 5.32 H new ATOM 0 HB2 ASP A 147 -6.609 -2.778 -7.084 1.00 71.31 H new ATOM 0 HB3 ASP A 147 -6.614 -3.308 -5.414 1.00 71.31 H new ATOM 2216 N LYS A 148 -5.834 0.917 -6.309 1.00 63.34 N ATOM 2217 CA LYS A 148 -4.799 1.711 -6.993 1.00 15.35 C ATOM 2218 C LYS A 148 -4.258 2.735 -5.996 1.00 75.14 C ATOM 2219 O LYS A 148 -5.062 3.429 -5.378 1.00 23.05 O ATOM 2220 CB LYS A 148 -5.367 2.421 -8.242 1.00 54.31 C ATOM 2221 CG LYS A 148 -4.817 1.822 -9.542 1.00 11.32 C ATOM 2222 CD LYS A 148 -3.755 2.766 -10.128 1.00 13.23 C ATOM 2223 CE LYS A 148 -2.592 2.049 -10.785 1.00 24.34 C ATOM 2224 NZ LYS A 148 -2.910 1.282 -12.005 1.00 13.41 N ATOM 0 H LYS A 148 -6.139 1.346 -5.435 1.00 63.34 H new ATOM 0 HA LYS A 148 -4.001 1.053 -7.337 1.00 15.35 H new ATOM 0 HB2 LYS A 148 -6.454 2.345 -8.239 1.00 54.31 H new ATOM 0 HB3 LYS A 148 -5.121 3.482 -8.199 1.00 54.31 H new ATOM 0 HG2 LYS A 148 -4.381 0.842 -9.348 1.00 11.32 H new ATOM 0 HG3 LYS A 148 -5.625 1.676 -10.259 1.00 11.32 H new ATOM 0 HD2 LYS A 148 -4.228 3.419 -10.862 1.00 13.23 H new ATOM 0 HD3 LYS A 148 -3.372 3.405 -9.332 1.00 13.23 H new ATOM 0 HE2 LYS A 148 -1.829 2.787 -11.032 1.00 24.34 H new ATOM 0 HE3 LYS A 148 -2.152 1.368 -10.056 1.00 24.34 H new ATOM 0 HZ1 LYS A 148 -2.534 0.317 -11.916 1.00 13.41 H new ATOM 0 HZ2 LYS A 148 -3.942 1.241 -12.131 1.00 13.41 H new ATOM 0 HZ3 LYS A 148 -2.479 1.747 -12.829 1.00 13.41 H new ATOM 2238 N ILE A 149 -2.939 2.873 -5.836 1.00 55.34 N ATOM 2239 CA ILE A 149 -2.338 3.925 -5.005 1.00 64.31 C ATOM 2240 C ILE A 149 -1.165 4.514 -5.791 1.00 23.21 C ATOM 2241 O ILE A 149 -0.472 3.794 -6.504 1.00 44.40 O ATOM 2242 CB ILE A 149 -1.899 3.392 -3.613 1.00 0.24 C ATOM 2243 CG1 ILE A 149 -3.031 2.685 -2.832 1.00 62.20 C ATOM 2244 CG2 ILE A 149 -1.361 4.516 -2.700 1.00 62.50 C ATOM 2245 CD1 ILE A 149 -3.075 1.171 -3.033 1.00 74.24 C ATOM 0 H ILE A 149 -2.255 2.259 -6.279 1.00 55.34 H new ATOM 0 HA ILE A 149 -3.074 4.700 -4.794 1.00 64.31 H new ATOM 0 HB ILE A 149 -1.116 2.671 -3.848 1.00 0.24 H new ATOM 0 HG12 ILE A 149 -2.912 2.897 -1.769 1.00 62.20 H new ATOM 0 HG13 ILE A 149 -3.988 3.109 -3.136 1.00 62.20 H new ATOM 0 HG21 ILE A 149 -1.067 4.095 -1.739 1.00 62.50 H new ATOM 0 HG22 ILE A 149 -0.497 4.984 -3.171 1.00 62.50 H new ATOM 0 HG23 ILE A 149 -2.139 5.263 -2.546 1.00 62.50 H new ATOM 0 HD11 ILE A 149 -3.896 0.751 -2.452 1.00 74.24 H new ATOM 0 HD12 ILE A 149 -3.226 0.948 -4.089 1.00 74.24 H new ATOM 0 HD13 ILE A 149 -2.134 0.732 -2.701 1.00 74.24 H new ATOM 2257 N THR A 150 -0.914 5.809 -5.656 1.00 44.23 N ATOM 2258 CA THR A 150 0.239 6.494 -6.220 1.00 62.24 C ATOM 2259 C THR A 150 0.752 7.476 -5.168 1.00 43.30 C ATOM 2260 O THR A 150 0.028 7.839 -4.233 1.00 3.11 O ATOM 2261 CB THR A 150 -0.131 7.186 -7.551 1.00 3.44 C ATOM 2262 OG1 THR A 150 -1.265 8.021 -7.394 1.00 14.51 O ATOM 2263 CG2 THR A 150 -0.428 6.209 -8.688 1.00 54.32 C ATOM 0 H THR A 150 -1.529 6.432 -5.133 1.00 44.23 H new ATOM 0 HA THR A 150 1.032 5.788 -6.465 1.00 62.24 H new ATOM 0 HB THR A 150 0.751 7.768 -7.818 1.00 3.44 H new ATOM 0 HG1 THR A 150 -1.477 8.448 -8.250 1.00 14.51 H new ATOM 0 HG21 THR A 150 -0.680 6.766 -9.590 1.00 54.32 H new ATOM 0 HG22 THR A 150 0.451 5.592 -8.876 1.00 54.32 H new ATOM 0 HG23 THR A 150 -1.267 5.571 -8.410 1.00 54.32 H new ATOM 2271 N ILE A 151 1.990 7.932 -5.326 1.00 61.30 N ATOM 2272 CA ILE A 151 2.568 8.989 -4.509 1.00 51.24 C ATOM 2273 C ILE A 151 2.954 10.091 -5.481 1.00 4.33 C ATOM 2274 O ILE A 151 3.264 9.834 -6.649 1.00 42.32 O ATOM 2275 CB ILE A 151 3.728 8.444 -3.648 1.00 60.40 C ATOM 2276 CG1 ILE A 151 3.176 7.422 -2.624 1.00 20.05 C ATOM 2277 CG2 ILE A 151 4.494 9.545 -2.890 1.00 40.21 C ATOM 2278 CD1 ILE A 151 3.710 6.012 -2.866 1.00 21.02 C ATOM 0 H ILE A 151 2.628 7.572 -6.036 1.00 61.30 H new ATOM 0 HA ILE A 151 1.873 9.393 -3.773 1.00 51.24 H new ATOM 0 HB ILE A 151 4.432 7.974 -4.335 1.00 60.40 H new ATOM 0 HG12 ILE A 151 3.442 7.741 -1.616 1.00 20.05 H new ATOM 0 HG13 ILE A 151 2.087 7.410 -2.677 1.00 20.05 H new ATOM 0 HG21 ILE A 151 5.295 9.094 -2.305 1.00 40.21 H new ATOM 0 HG22 ILE A 151 4.919 10.250 -3.604 1.00 40.21 H new ATOM 0 HG23 ILE A 151 3.810 10.071 -2.224 1.00 40.21 H new ATOM 0 HD11 ILE A 151 3.294 5.333 -2.122 1.00 21.02 H new ATOM 0 HD12 ILE A 151 3.421 5.680 -3.863 1.00 21.02 H new ATOM 0 HD13 ILE A 151 4.797 6.016 -2.786 1.00 21.02 H new ATOM 2290 N ASP A 152 2.829 11.328 -5.016 1.00 75.11 N ATOM 2291 CA ASP A 152 3.074 12.493 -5.843 1.00 64.12 C ATOM 2292 C ASP A 152 4.551 12.795 -5.958 1.00 72.20 C ATOM 2293 O ASP A 152 5.288 12.680 -4.956 1.00 74.23 O ATOM 2294 CB ASP A 152 2.309 13.720 -5.370 1.00 12.33 C ATOM 2295 CG ASP A 152 2.231 14.743 -6.500 1.00 15.14 C ATOM 2296 OD1 ASP A 152 1.957 14.363 -7.666 1.00 33.44 O ATOM 2297 OD2 ASP A 152 2.302 15.948 -6.178 1.00 40.34 O ATOM 0 H ASP A 152 2.556 11.547 -4.058 1.00 75.11 H new ATOM 0 HA ASP A 152 2.698 12.243 -6.835 1.00 64.12 H new ATOM 0 HB2 ASP A 152 1.305 13.436 -5.054 1.00 12.33 H new ATOM 0 HB3 ASP A 152 2.804 14.158 -4.503 1.00 12.33 H new